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-])c1cc(Cl)ccc1C[NH+]1CCC(c2ccc(O)cc2)CC1 ZINC000533020727 1032449405 /nfs/dbraw/zinc/44/94/05/1032449405.db2.gz CWEPJYFXBIMJNI-UHFFFAOYSA-N 1 1 346.814 4.333 20 5 EIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000609541335 1019966829 /nfs/dbraw/zinc/96/68/29/1019966829.db2.gz IMTMFTVSEQEBNS-OAHLLOKOSA-N 1 1 346.814 4.117 20 5 EIBDMO CCc1ccc([C@@H](COC)[NH2+][C@@H](CC)c2cccc([N+](=O)[O-])c2)o1 ZINC000165286672 1020040761 /nfs/dbraw/zinc/04/07/61/1020040761.db2.gz GNCWBTJEUCJFDU-DLBZAZTESA-N 1 1 332.400 4.179 20 5 EIBDMO C[C@@H]1CCCCC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000547931360 1020895247 /nfs/dbraw/zinc/89/52/47/1020895247.db2.gz QJFNDNXWBZQUNE-CYBMUJFWSA-N 1 1 331.441 4.483 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000610368734 1021543226 /nfs/dbraw/zinc/54/32/26/1021543226.db2.gz HTFCLJOEZCKRAB-DNVCBOLYSA-N 1 1 326.396 4.119 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC(C[NH+]2CCCCCC2)CC1 ZINC000610367494 1021543966 /nfs/dbraw/zinc/54/39/66/1021543966.db2.gz KQCOIFVLARQLKO-KRWDZBQOSA-N 1 1 345.487 4.244 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](CSc3ccccc3)C2)cc1 ZINC000610370724 1021549834 /nfs/dbraw/zinc/54/98/34/1021549834.db2.gz PHKYRJGAAKXWGI-MRXNPFEDSA-N 1 1 328.437 4.209 20 5 EIBDMO CC[C@H]1Cc2ccccc2C[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000613497417 1022188882 /nfs/dbraw/zinc/18/88/82/1022188882.db2.gz OYYMTCORPCZVQJ-HNNXBMFYSA-N 1 1 337.379 4.073 20 5 EIBDMO CC[C@H]1Cc2ccccc2C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000613497417 1022188897 /nfs/dbraw/zinc/18/88/97/1022188897.db2.gz OYYMTCORPCZVQJ-HNNXBMFYSA-N 1 1 337.379 4.073 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2nc(-c3ccccc3F)cs2)cc1 ZINC000378127293 1022397391 /nfs/dbraw/zinc/39/73/91/1022397391.db2.gz KFNWDLPTWAKMPA-UHFFFAOYSA-N 1 1 343.383 4.147 20 5 EIBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H]1CC[C@H](O)CC1 ZINC000275990925 1022568502 /nfs/dbraw/zinc/56/85/02/1022568502.db2.gz MSFWOSWBVKVDSK-HDJSIYSDSA-N 1 1 346.452 4.059 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCc2ccc(F)c(F)c2)C2CC2)c1 ZINC001167734657 1022650233 /nfs/dbraw/zinc/65/02/33/1022650233.db2.gz PNAOENAPCIVGIK-UHFFFAOYSA-N 1 1 332.350 4.080 20 5 EIBDMO C[C@H]1[C@@H](c2ccccc2)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000177551877 1022972930 /nfs/dbraw/zinc/97/29/30/1022972930.db2.gz FZWOCFFNQUYMSO-BBRMVZONSA-N 1 1 337.379 4.114 20 5 EIBDMO COCCc1cc[nH+]c(N[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000417319238 1023262143 /nfs/dbraw/zinc/26/21/43/1023262143.db2.gz BKRUPEBEARXIMR-GOSISDBHSA-N 1 1 341.411 4.058 20 5 EIBDMO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1nccn1-c1ccccc1 ZINC000376802738 1023314009 /nfs/dbraw/zinc/31/40/09/1023314009.db2.gz SJEOVEBAPWUILS-LSDHHAIUSA-N 1 1 336.395 4.192 20 5 EIBDMO CCC[C@H]1[C@@H](C)CCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000072776097 1023845331 /nfs/dbraw/zinc/84/53/31/1023845331.db2.gz JZISCOJRGMEVCL-BBRMVZONSA-N 1 1 344.415 4.045 20 5 EIBDMO C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])s2)CC[N@H+]1Cc1ccccc1 ZINC000610573518 1023947141 /nfs/dbraw/zinc/94/71/41/1023947141.db2.gz NVHGEZBRZXKCPC-UKRRQHHQSA-N 1 1 331.441 4.121 20 5 EIBDMO Cc1c(C[N@H+]2CCC[C@H]2CC(=O)c2cccs2)cccc1[N+](=O)[O-] ZINC000430995267 1024377576 /nfs/dbraw/zinc/37/75/76/1024377576.db2.gz CYICQFXLYRJHTD-HNNXBMFYSA-N 1 1 344.436 4.202 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]C(c1ccccc1)c1ccccc1 ZINC000014915594 1024955738 /nfs/dbraw/zinc/95/57/38/1024955738.db2.gz VDUJGGXGIONINB-UHFFFAOYSA-N 1 1 348.402 4.483 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2ccc(C)s2)C(C)C)cc1[N+](=O)[O-] ZINC000065162670 1025055080 /nfs/dbraw/zinc/05/50/80/1025055080.db2.gz MEVFSTMIVDGTEN-UHFFFAOYSA-N 1 1 334.441 4.384 20 5 EIBDMO CCc1ccc([C@@H](COC)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000165247129 1025136258 /nfs/dbraw/zinc/13/62/58/1025136258.db2.gz QARKOLCXTIYEEJ-CZUORRHYSA-N 1 1 332.400 4.097 20 5 EIBDMO CCc1ccc([C@H](COC)[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)o1 ZINC000165260936 1025174317 /nfs/dbraw/zinc/17/43/17/1025174317.db2.gz UUDDCRDPKDRPQK-GUYCJALGSA-N 1 1 332.400 4.097 20 5 EIBDMO C[N@H+]1CC[C@@H](Nc2ccnc3c2cccc3[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000432334823 1025646432 /nfs/dbraw/zinc/64/64/32/1025646432.db2.gz KMEAXGYKCRHSSF-YLJYHZDGSA-N 1 1 348.406 4.000 20 5 EIBDMO COc1cc(C[N@@H+](C)C(C)(C)c2ccccc2)c([N+](=O)[O-])cc1F ZINC000585754710 1025823888 /nfs/dbraw/zinc/82/38/88/1025823888.db2.gz WBJDQIQKRMQOLA-UHFFFAOYSA-N 1 1 332.375 4.110 20 5 EIBDMO CC(C)[C@H]1CCC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000507190408 1026695663 /nfs/dbraw/zinc/69/56/63/1026695663.db2.gz ZFUWZQOFGVBCTF-MRXNPFEDSA-N 1 1 331.441 4.339 20 5 EIBDMO C[N@@H+](CCc1cccc2ccccc21)Cc1csc([N+](=O)[O-])c1 ZINC000507281782 1026731606 /nfs/dbraw/zinc/73/16/06/1026731606.db2.gz URHVEBAVAXIBOU-UHFFFAOYSA-N 1 1 326.421 4.484 20 5 EIBDMO CC[NH+](CC)Cc1ccccc1CN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000120897537 1027432853 /nfs/dbraw/zinc/43/28/53/1027432853.db2.gz NZPIXYVUTGVYMP-MRXNPFEDSA-N 1 1 341.455 4.287 20 5 EIBDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000441323756 1027447253 /nfs/dbraw/zinc/44/72/53/1027447253.db2.gz OGEQIEOMXCWLMF-AUUYWEPGSA-N 1 1 328.387 4.360 20 5 EIBDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000441335330 1027450721 /nfs/dbraw/zinc/45/07/21/1027450721.db2.gz FOADINQQQMURIR-KZULUSFZSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000441335330 1027450734 /nfs/dbraw/zinc/45/07/34/1027450734.db2.gz FOADINQQQMURIR-KZULUSFZSA-N 1 1 332.350 4.456 20 5 EIBDMO Cc1c(C[N@@H+]2CCSC[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000522468696 1027453778 /nfs/dbraw/zinc/45/37/78/1027453778.db2.gz RUMGSCMHWOPXAM-SFHVURJKSA-N 1 1 328.437 4.193 20 5 EIBDMO Cc1c(C[N@H+]2CCSC[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000522468696 1027453785 /nfs/dbraw/zinc/45/37/85/1027453785.db2.gz RUMGSCMHWOPXAM-SFHVURJKSA-N 1 1 328.437 4.193 20 5 EIBDMO CC[C@H](Cc1ccccc1)[N@@H+](CC)Cc1ccc([N+](=O)[O-])cc1OC ZINC001168074685 1027738738 /nfs/dbraw/zinc/73/87/38/1027738738.db2.gz VXYMTDPCLDYQPN-GOSISDBHSA-N 1 1 342.439 4.447 20 5 EIBDMO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccc(Cl)cc1 ZINC000444602923 1027884952 /nfs/dbraw/zinc/88/49/52/1027884952.db2.gz NVKNFJOTERSVFH-UHFFFAOYSA-N 1 1 344.802 4.147 20 5 EIBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccc(Cl)cc1 ZINC000444602923 1027884958 /nfs/dbraw/zinc/88/49/58/1027884958.db2.gz NVKNFJOTERSVFH-UHFFFAOYSA-N 1 1 344.802 4.147 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCCC4(CCCCC4)C3)nc2c1 ZINC000444637867 1027895112 /nfs/dbraw/zinc/89/51/12/1027895112.db2.gz HHCBOVJGJWBDMP-UHFFFAOYSA-N 1 1 328.416 4.017 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+](C3CC3)[C@@H]3CCc4ccccc43)nc2c1 ZINC000444652944 1027923803 /nfs/dbraw/zinc/92/38/03/1027923803.db2.gz UYCOQQGURNTQDF-LJQANCHMSA-N 1 1 348.406 4.123 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+](C3CC3)[C@@H]3CCc4ccccc43)nc2c1 ZINC000444652944 1027923820 /nfs/dbraw/zinc/92/38/20/1027923820.db2.gz UYCOQQGURNTQDF-LJQANCHMSA-N 1 1 348.406 4.123 20 5 EIBDMO Cc1ccc([C@H]2CCC[N@@H+]2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)s1 ZINC000444639533 1027934504 /nfs/dbraw/zinc/93/45/04/1027934504.db2.gz AIBDOMYODKKXKK-OAHLLOKOSA-N 1 1 342.424 4.178 20 5 EIBDMO Cc1ccc([C@H]2CCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)s1 ZINC000444639533 1027934523 /nfs/dbraw/zinc/93/45/23/1027934523.db2.gz AIBDOMYODKKXKK-OAHLLOKOSA-N 1 1 342.424 4.178 20 5 EIBDMO CC1CCC([N@H+](Cc2csc([N+](=O)[O-])c2)C[C@@H]2CCCO2)CC1 ZINC000441442256 1027984381 /nfs/dbraw/zinc/98/43/81/1027984381.db2.gz SSMMZIJIFOIOLV-BCLQGDPASA-N 1 1 338.473 4.216 20 5 EIBDMO COc1ccccc1[C@H]1CC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000524252171 1028815828 /nfs/dbraw/zinc/81/58/28/1028815828.db2.gz DHIYEDBSZKHACB-ZDUSSCGKSA-N 1 1 346.814 4.246 20 5 EIBDMO Cc1c(C[N@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)cccc1[N+](=O)[O-] ZINC000523007647 1029347340 /nfs/dbraw/zinc/34/73/40/1029347340.db2.gz UHQJINUEWJYQKC-INIZCTEOSA-N 1 1 328.387 4.107 20 5 EIBDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2csc([N+](=O)[O-])c2)C12CCCCC2 ZINC000525126730 1029466416 /nfs/dbraw/zinc/46/64/16/1029466416.db2.gz LHFNUHIWYVMVNG-LSDHHAIUSA-N 1 1 338.473 4.216 20 5 EIBDMO O=[N+]([O-])c1cccc(C[NH2+][C@H]2COc3c2ccc(Cl)c3Cl)c1 ZINC000525182435 1029501830 /nfs/dbraw/zinc/50/18/30/1029501830.db2.gz XETDDPKWXXZWEV-ZDUSSCGKSA-N 1 1 339.178 4.125 20 5 EIBDMO COCCCC[N@@H+](Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1C ZINC000052798287 1029615235 /nfs/dbraw/zinc/61/52/35/1029615235.db2.gz SGVSRLULIPWIDS-UHFFFAOYSA-N 1 1 342.439 4.332 20 5 EIBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@@H]1CCCC[C@H]1O ZINC000428471915 1029706551 /nfs/dbraw/zinc/70/65/51/1029706551.db2.gz DDWIRUUYAFQLCN-IAGOWNOFSA-N 1 1 346.452 4.059 20 5 EIBDMO C[C@H]1CCC[N@H+](C(C)(C)CNc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000480489922 1030137547 /nfs/dbraw/zinc/13/75/47/1030137547.db2.gz LWOHNDDUCGTCPE-AWEZNQCLSA-N 1 1 342.443 4.065 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@H]1COc3ccc(Cl)cc31)CCC2 ZINC000447583423 1030181252 /nfs/dbraw/zinc/18/12/52/1030181252.db2.gz BKFHWZOWKSZZPQ-IRXDYDNUSA-N 1 1 344.798 4.349 20 5 EIBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CC[C@H](c3cccc(F)c3)C2)c(F)c1 ZINC000509658346 1030240099 /nfs/dbraw/zinc/24/00/99/1030240099.db2.gz PJKSGZKAZDNGSH-LBPRGKRZSA-N 1 1 336.313 4.002 20 5 EIBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)c(F)c1 ZINC000509658346 1030240122 /nfs/dbraw/zinc/24/01/22/1030240122.db2.gz PJKSGZKAZDNGSH-LBPRGKRZSA-N 1 1 336.313 4.002 20 5 EIBDMO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000026475235 1030308672 /nfs/dbraw/zinc/30/86/72/1030308672.db2.gz VKBCPEYSBFCXMJ-FOIQADDNSA-N 1 1 333.391 4.430 20 5 EIBDMO COc1cccc(Cl)c1C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000515106945 1030395883 /nfs/dbraw/zinc/39/58/83/1030395883.db2.gz GGLLAPGIEJPABN-GFCCVEGCSA-N 1 1 334.803 4.416 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H]2CCC2CCCC2)cc1 ZINC001168175579 1030683023 /nfs/dbraw/zinc/68/30/23/1030683023.db2.gz OKNQIRVEPUWKCA-IEBWSBKVSA-N 1 1 332.444 4.063 20 5 EIBDMO CO[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000611984160 1030709166 /nfs/dbraw/zinc/70/91/66/1030709166.db2.gz MPXJXCXSCBTPGB-MRXNPFEDSA-N 1 1 346.452 4.324 20 5 EIBDMO CCCn1nc(C)c(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1C ZINC000179320174 1030898731 /nfs/dbraw/zinc/89/87/31/1030898731.db2.gz FXWPWBUERBCHCF-UHFFFAOYSA-N 1 1 344.459 4.229 20 5 EIBDMO CC(C)([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccccc1Br ZINC000179329292 1030911190 /nfs/dbraw/zinc/91/11/90/1030911190.db2.gz KGAIKZZVQQJMAS-UHFFFAOYSA-N 1 1 349.228 4.382 20 5 EIBDMO C[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1cccc(OC(F)F)c1 ZINC000179591292 1031214932 /nfs/dbraw/zinc/21/49/32/1031214932.db2.gz MATYBSNEPOWRNT-SNVBAGLBSA-N 1 1 340.301 4.186 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000548934992 1031586498 /nfs/dbraw/zinc/58/64/98/1031586498.db2.gz ZPSUDXIOKQUZDQ-CQSZACIVSA-N 1 1 328.334 4.149 20 5 EIBDMO COC[C@@]1(C)CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000449398811 1031701417 /nfs/dbraw/zinc/70/14/17/1031701417.db2.gz YZFXNSSNGJRUPB-SFHVURJKSA-N 1 1 346.452 4.182 20 5 EIBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@H]1C ZINC000449493557 1031787852 /nfs/dbraw/zinc/78/78/52/1031787852.db2.gz FCEZFZBTXWDNNO-DYVFJYSZSA-N 1 1 346.452 4.180 20 5 EIBDMO CCO[C@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H]1C ZINC000449501735 1031809327 /nfs/dbraw/zinc/80/93/27/1031809327.db2.gz WBKZSDDTANMABX-KDOFPFPSSA-N 1 1 344.411 4.102 20 5 EIBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@@H]1C ZINC000449505627 1031814169 /nfs/dbraw/zinc/81/41/69/1031814169.db2.gz RIDOPOUFCBCPDI-GUYCJALGSA-N 1 1 346.452 4.180 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000595018507 1035506983 /nfs/dbraw/zinc/50/69/83/1035506983.db2.gz QPVGREWMCAMYGB-MKBNYLNASA-N 1 1 330.384 4.171 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccc(F)c(Cl)c1 ZINC000595029901 1035561265 /nfs/dbraw/zinc/56/12/65/1035561265.db2.gz AHXQFNJQTPIBLB-JTQLQIEISA-N 1 1 338.766 4.247 20 5 EIBDMO CC[C@H](c1ccccc1)[C@@H]1CCC[N@H+]1Cc1onc(C)c1[N+](=O)[O-] ZINC000595297325 1035626770 /nfs/dbraw/zinc/62/67/70/1035626770.db2.gz RHWFDLMKOCGLGP-CVEARBPZSA-N 1 1 329.400 4.049 20 5 EIBDMO COc1ccc([C@H]2CCCCC[N@@H+]2Cc2onc(C)c2[N+](=O)[O-])cc1 ZINC000595286168 1035630299 /nfs/dbraw/zinc/63/02/99/1035630299.db2.gz DGZRYNZGQIMKTM-MRXNPFEDSA-N 1 1 345.399 4.017 20 5 EIBDMO COc1ccc([C@H]2CCCCC[N@H+]2Cc2onc(C)c2[N+](=O)[O-])cc1 ZINC000595286168 1035630322 /nfs/dbraw/zinc/63/03/22/1035630322.db2.gz DGZRYNZGQIMKTM-MRXNPFEDSA-N 1 1 345.399 4.017 20 5 EIBDMO Cc1cccc(NC2CC[NH+](Cc3ccc(F)cc3[N+](=O)[O-])CC2)c1 ZINC000595375492 1035670908 /nfs/dbraw/zinc/67/09/08/1035670908.db2.gz BIBLZTUJZDEVNN-UHFFFAOYSA-N 1 1 343.402 4.119 20 5 EIBDMO COc1ccc(C[N@@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)cc1Cl ZINC000485080890 1035676460 /nfs/dbraw/zinc/67/64/60/1035676460.db2.gz SMSJRWCSXLTRSN-GFCCVEGCSA-N 1 1 334.803 4.450 20 5 EIBDMO Cc1noc(C[NH2+][C@H](c2ccc(CC(C)C)cc2)C2CC2)c1[N+](=O)[O-] ZINC000595426389 1035677353 /nfs/dbraw/zinc/67/73/53/1035677353.db2.gz URVJYOBVYBPJFA-GOSISDBHSA-N 1 1 343.427 4.331 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3ccccn3)C2)c(Cl)c1 ZINC000595502410 1035689503 /nfs/dbraw/zinc/68/95/03/1035689503.db2.gz UDBISKNNWCCAEN-AWEZNQCLSA-N 1 1 331.803 4.023 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC([C@@H]3CCCCO3)CC2)c(Cl)c1 ZINC000595781187 1035794661 /nfs/dbraw/zinc/79/46/61/1035794661.db2.gz AGBVQJSMDHZAMU-KRWDZBQOSA-N 1 1 338.835 4.029 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]3CCC[C@H]32)ccc1Br ZINC000227987495 1036032527 /nfs/dbraw/zinc/03/25/27/1036032527.db2.gz FZYLKPNPTSKSED-TZMCWYRMSA-N 1 1 339.233 4.122 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]3CCC[C@H]32)ccc1Br ZINC000227987495 1036032541 /nfs/dbraw/zinc/03/25/41/1036032541.db2.gz FZYLKPNPTSKSED-TZMCWYRMSA-N 1 1 339.233 4.122 20 5 EIBDMO COCc1csc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000596979087 1036063506 /nfs/dbraw/zinc/06/35/06/1036063506.db2.gz IFZOIMKGYNFIQS-UHFFFAOYSA-N 1 1 334.441 4.213 20 5 EIBDMO COc1cc(C[N@H+]2CCC[C@H]2c2ccccc2C)ccc1[N+](=O)[O-] ZINC000485746960 1036238986 /nfs/dbraw/zinc/23/89/86/1036238986.db2.gz USYLFFHSUOJQSB-KRWDZBQOSA-N 1 1 326.396 4.249 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccccc1N1CCCC1 ZINC000485893217 1036356288 /nfs/dbraw/zinc/35/62/88/1036356288.db2.gz GKHIRJPVPOOJRJ-MRXNPFEDSA-N 1 1 339.439 4.388 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1N1CCCC1 ZINC000485893217 1036356310 /nfs/dbraw/zinc/35/63/10/1036356310.db2.gz GKHIRJPVPOOJRJ-MRXNPFEDSA-N 1 1 339.439 4.388 20 5 EIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)C[C@@H](C)C(C)(C)C ZINC000603056999 1036715319 /nfs/dbraw/zinc/71/53/19/1036715319.db2.gz YBAOMPHPVZFQBZ-CHWSQXEVSA-N 1 1 346.431 4.320 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](c1ccccn1)C1CCC1 ZINC000599068007 1036868049 /nfs/dbraw/zinc/86/80/49/1036868049.db2.gz JPKYXUCWNSWFAR-ORAYPTAESA-N 1 1 341.411 4.190 20 5 EIBDMO COc1ccc(C[N@@H+](C)[C@H](C)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000603840686 1037024279 /nfs/dbraw/zinc/02/42/79/1037024279.db2.gz SQTMHPWJINREDY-GFCCVEGCSA-N 1 1 334.803 4.450 20 5 EIBDMO Cc1ccc([C@@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000603836949 1037033008 /nfs/dbraw/zinc/03/30/08/1037033008.db2.gz DCAMWXVHDIHRBM-KRWDZBQOSA-N 1 1 326.396 4.119 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1cccc2ccccc21 ZINC000603851011 1037044615 /nfs/dbraw/zinc/04/46/15/1037044615.db2.gz ZHRRMZVSDIAWMT-UHFFFAOYSA-N 1 1 336.391 4.389 20 5 EIBDMO C[C@H]1CCCC[N@H+]1CCCCNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000603859484 1037052412 /nfs/dbraw/zinc/05/24/12/1037052412.db2.gz BOGIKCVYHYRMTN-HNNXBMFYSA-N 1 1 342.443 4.210 20 5 EIBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1ccc([N+](=O)[O-])cc1Cl ZINC000603859502 1037053475 /nfs/dbraw/zinc/05/34/75/1037053475.db2.gz FKAVRUHKTYXECD-CYBMUJFWSA-N 1 1 325.840 4.315 20 5 EIBDMO CC(C)c1ccc(C[N@H+]2CC3(CCOCC3)[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC000590380239 1037056817 /nfs/dbraw/zinc/05/68/17/1037056817.db2.gz WIDUAJVSIYPODQ-LJQANCHMSA-N 1 1 344.455 4.109 20 5 EIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCCC(F)(F)CC2)c1 ZINC000599552972 1037072078 /nfs/dbraw/zinc/07/20/78/1037072078.db2.gz ORNUFQAKZCDTMC-UHFFFAOYSA-N 1 1 338.276 4.235 20 5 EIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCCC(F)(F)CC2)c1 ZINC000599552972 1037072095 /nfs/dbraw/zinc/07/20/95/1037072095.db2.gz ORNUFQAKZCDTMC-UHFFFAOYSA-N 1 1 338.276 4.235 20 5 EIBDMO C[C@@H]1c2ccsc2CC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000604012530 1037146785 /nfs/dbraw/zinc/14/67/85/1037146785.db2.gz MOFNFTBUFWORTD-CYBMUJFWSA-N 1 1 332.425 4.045 20 5 EIBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@H]2c2ccc(F)cc2)cc1 ZINC000604012539 1037147520 /nfs/dbraw/zinc/14/75/20/1037147520.db2.gz NXQIKXYRIDWOSK-IBGZPJMESA-N 1 1 344.386 4.340 20 5 EIBDMO C[C@@H](c1ccccc1F)[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000604013583 1037147745 /nfs/dbraw/zinc/14/77/45/1037147745.db2.gz RCVUEZSDRCSKQZ-AWEZNQCLSA-N 1 1 332.375 4.196 20 5 EIBDMO Cc1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2C)CC2CC2)cn1 ZINC000592145653 1037753721 /nfs/dbraw/zinc/75/37/21/1037753721.db2.gz YDUJBLBGDUMFLX-UHFFFAOYSA-N 1 1 325.412 4.019 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1csc2ccccc12 ZINC000058582122 1037872479 /nfs/dbraw/zinc/87/24/79/1037872479.db2.gz HGPBMGVWQUIADP-UHFFFAOYSA-N 1 1 342.420 4.450 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1csc2ccccc12 ZINC000058582122 1037872482 /nfs/dbraw/zinc/87/24/82/1037872482.db2.gz HGPBMGVWQUIADP-UHFFFAOYSA-N 1 1 342.420 4.450 20 5 EIBDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000574319039 1038167043 /nfs/dbraw/zinc/16/70/43/1038167043.db2.gz BMHRLNHGYGDXCQ-QGZVFWFLSA-N 1 1 342.443 4.395 20 5 EIBDMO C[C@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)c1ccccc1[N+](=O)[O-] ZINC000504416516 1038359165 /nfs/dbraw/zinc/35/91/65/1038359165.db2.gz QGXRBZYMCGBTNI-ZDUSSCGKSA-N 1 1 329.400 4.018 20 5 EIBDMO COc1ccccc1[C@@H]1CC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000537615048 1038895317 /nfs/dbraw/zinc/89/53/17/1038895317.db2.gz JZJKMCMWQSOMSE-BQLWYNFJSA-N 1 1 338.407 4.106 20 5 EIBDMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000534108686 1039128679 /nfs/dbraw/zinc/12/86/79/1039128679.db2.gz STTWNPBVIBXMQW-INIZCTEOSA-N 1 1 329.400 4.260 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1ccncc1F ZINC000509992165 1039838860 /nfs/dbraw/zinc/83/88/60/1039838860.db2.gz YLAVBLLBCOHLKG-GFCCVEGCSA-N 1 1 341.342 4.240 20 5 EIBDMO CCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccc(F)cc1 ZINC000434836555 1039881791 /nfs/dbraw/zinc/88/17/91/1039881791.db2.gz OBPURSLSGXHVPW-UHFFFAOYSA-N 1 1 343.358 4.287 20 5 EIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1c1cccc(C)n1 ZINC000159707675 1040178392 /nfs/dbraw/zinc/17/83/92/1040178392.db2.gz WWKQMORHKOOPTF-GOSISDBHSA-N 1 1 341.411 4.034 20 5 EIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1c1cccc(C)n1 ZINC000159707675 1040178415 /nfs/dbraw/zinc/17/84/15/1040178415.db2.gz WWKQMORHKOOPTF-GOSISDBHSA-N 1 1 341.411 4.034 20 5 EIBDMO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000482517578 1040314612 /nfs/dbraw/zinc/31/46/12/1040314612.db2.gz ZSVQUNJOXIGPFU-APECEVEPSA-N 1 1 328.334 4.271 20 5 EIBDMO CCc1nc(C)c([C@@H](C)[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)s1 ZINC000122165778 1040329344 /nfs/dbraw/zinc/32/93/44/1040329344.db2.gz OTKRDRQEIMFYED-CYBMUJFWSA-N 1 1 333.457 4.158 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3nc4ccccc4o3)C2)cc1 ZINC000029833342 1040465931 /nfs/dbraw/zinc/46/59/31/1040465931.db2.gz GWNOXCWIFVWUDE-OAHLLOKOSA-N 1 1 337.379 4.116 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+](Cc3ccccc3)C3CC3)co2)cc1 ZINC000089883036 1040504075 /nfs/dbraw/zinc/50/40/75/1040504075.db2.gz JKJWANGIYIQFDV-UHFFFAOYSA-N 1 1 349.390 4.414 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+](Cc3ccccc3)C3CC3)co2)cc1 ZINC000089883036 1040504089 /nfs/dbraw/zinc/50/40/89/1040504089.db2.gz JKJWANGIYIQFDV-UHFFFAOYSA-N 1 1 349.390 4.414 20 5 EIBDMO CC[C@H](C)C[N@@H+](CC)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000160552463 1040595397 /nfs/dbraw/zinc/59/53/97/1040595397.db2.gz ZMUMNLQRPFLOKV-STQMWFEESA-N 1 1 332.404 4.074 20 5 EIBDMO C[N@@H+](CCCOc1ccc(Cl)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC000515495918 1040801751 /nfs/dbraw/zinc/80/17/51/1040801751.db2.gz KFHOYKJNHMIAPD-UHFFFAOYSA-N 1 1 334.803 4.149 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](C(F)(F)F)C(C)(C)C1 ZINC000483448805 1040854913 /nfs/dbraw/zinc/85/49/13/1040854913.db2.gz NNGFUFAADZSEGG-AWEZNQCLSA-N 1 1 330.350 4.314 20 5 EIBDMO COc1ccc2c(c1)CCC[C@H]2[N@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505786114 1041047635 /nfs/dbraw/zinc/04/76/35/1041047635.db2.gz YDECIJUVRMQETP-GOSISDBHSA-N 1 1 344.386 4.252 20 5 EIBDMO COc1ccc2c(c1)CCC[C@H]2[N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505786114 1041047647 /nfs/dbraw/zinc/04/76/47/1041047647.db2.gz YDECIJUVRMQETP-GOSISDBHSA-N 1 1 344.386 4.252 20 5 EIBDMO C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccc(Br)s1 ZINC000436413286 1041216485 /nfs/dbraw/zinc/21/64/85/1041216485.db2.gz OTRYZVFSELDDST-ZETCQYMHSA-N 1 1 347.259 4.331 20 5 EIBDMO CCCC1CCC([N@@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])CC1 ZINC000484870077 1041481856 /nfs/dbraw/zinc/48/18/56/1041481856.db2.gz YJQXVNOXZQYUOO-UHFFFAOYSA-N 1 1 347.459 4.132 20 5 EIBDMO C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000538726800 1041499052 /nfs/dbraw/zinc/49/90/52/1041499052.db2.gz YJQCWHAHASNPTR-HUUCEWRRSA-N 1 1 342.443 4.006 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463435168 1041568045 /nfs/dbraw/zinc/56/80/45/1041568045.db2.gz HNJPMNULCJZWGO-KGLIPLIRSA-N 1 1 346.349 4.156 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+](CCC(F)(F)F)CC2CC2)c(Cl)c1 ZINC000541071767 1041798497 /nfs/dbraw/zinc/79/84/97/1041798497.db2.gz FFGURGTUVVPYKH-UHFFFAOYSA-N 1 1 336.741 4.413 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCC(F)(F)F)CC2CC2)c(Cl)c1 ZINC000541071767 1041798503 /nfs/dbraw/zinc/79/85/03/1041798503.db2.gz FFGURGTUVVPYKH-UHFFFAOYSA-N 1 1 336.741 4.413 20 5 EIBDMO C[C@H]1c2ccccc2C[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000541201049 1041842758 /nfs/dbraw/zinc/84/27/58/1041842758.db2.gz JDFNRSQHIHQECM-AWEZNQCLSA-N 1 1 349.390 4.369 20 5 EIBDMO C[C@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC(C)(C)C1 ZINC000542251771 1042354177 /nfs/dbraw/zinc/35/41/77/1042354177.db2.gz AXMXONBWQVFMSG-CQSZACIVSA-N 1 1 343.427 4.160 20 5 EIBDMO C[C@H]1C[C@H]1c1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)o1 ZINC000030150811 1042492681 /nfs/dbraw/zinc/49/26/81/1042492681.db2.gz CKTASMDEKYBDTB-SCLBCKFNSA-N 1 1 326.396 4.476 20 5 EIBDMO C[C@H]1C[C@H]1c1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)o1 ZINC000030150811 1042492685 /nfs/dbraw/zinc/49/26/85/1042492685.db2.gz CKTASMDEKYBDTB-SCLBCKFNSA-N 1 1 326.396 4.476 20 5 EIBDMO Cc1c(C[N@@H+](CCc2cccc(F)c2)C2CC2)cccc1[N+](=O)[O-] ZINC000506484265 1042493108 /nfs/dbraw/zinc/49/31/08/1042493108.db2.gz YHHHYZIUHVRZEA-UHFFFAOYSA-N 1 1 328.387 4.249 20 5 EIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCS[C@H]2CCCC[C@H]21 ZINC000493312625 1042895223 /nfs/dbraw/zinc/89/52/23/1042895223.db2.gz ZFMPWBRUOVMUPI-CABCVRRESA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCS[C@H]2CCCC[C@H]21 ZINC000493312625 1042895228 /nfs/dbraw/zinc/89/52/28/1042895228.db2.gz ZFMPWBRUOVMUPI-CABCVRRESA-N 1 1 326.849 4.108 20 5 EIBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3c(Cl)cccc3[N+](=O)[O-])C2)cc1 ZINC000493505591 1042920864 /nfs/dbraw/zinc/92/08/64/1042920864.db2.gz XSHJGGPLOVCICI-CQSZACIVSA-N 1 1 346.814 4.246 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3ccoc3)o2)c(Cl)c1 ZINC000171050668 1043266860 /nfs/dbraw/zinc/26/68/60/1043266860.db2.gz FDIMIJMTKBTINT-UHFFFAOYSA-N 1 1 332.743 4.391 20 5 EIBDMO Cc1cc(N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c(Cl)cc1[N+](=O)[O-] ZINC000301769491 1043356410 /nfs/dbraw/zinc/35/64/10/1043356410.db2.gz INTCUQBYEXMJKZ-XJKSGUPXSA-N 1 1 349.862 4.010 20 5 EIBDMO C[C@H]1CCCC[N@H+]1CCCCNc1nc2ccc([N+](=O)[O-])cc2s1 ZINC000731206537 1043717996 /nfs/dbraw/zinc/71/79/96/1043717996.db2.gz KWCICDUYKZALLK-ZDUSSCGKSA-N 1 1 348.472 4.271 20 5 EIBDMO Cc1c(C[N@@H+]2[C@H](C)CO[C@@H](c3ccccc3)[C@H]2C)cccc1[N+](=O)[O-] ZINC000731892661 1043840517 /nfs/dbraw/zinc/84/05/17/1043840517.db2.gz JGBHDSBDQFBTPI-AKCHCHLHSA-N 1 1 340.423 4.254 20 5 EIBDMO Cc1c(C[N@H+]2[C@H](C)CO[C@@H](c3ccccc3)[C@H]2C)cccc1[N+](=O)[O-] ZINC000731892661 1043840521 /nfs/dbraw/zinc/84/05/21/1043840521.db2.gz JGBHDSBDQFBTPI-AKCHCHLHSA-N 1 1 340.423 4.254 20 5 EIBDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000766208896 1044487086 /nfs/dbraw/zinc/48/70/86/1044487086.db2.gz AKEKJQBAMFJRHJ-LBPRGKRZSA-N 1 1 334.803 4.017 20 5 EIBDMO Cc1cc(C)c([C@H](C)[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)c(C)c1 ZINC000543477049 1044681070 /nfs/dbraw/zinc/68/10/70/1044681070.db2.gz ZTKOGIPBSDNLDX-HNNXBMFYSA-N 1 1 325.412 4.034 20 5 EIBDMO Cc1cc(C)c([C@H](C)[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)c(C)c1 ZINC000543477049 1044681081 /nfs/dbraw/zinc/68/10/81/1044681081.db2.gz ZTKOGIPBSDNLDX-HNNXBMFYSA-N 1 1 325.412 4.034 20 5 EIBDMO CC(C)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H](C)c1ccccc1 ZINC000428853305 1044721094 /nfs/dbraw/zinc/72/10/94/1044721094.db2.gz WNZJLUJRCNXNQA-AWEZNQCLSA-N 1 1 338.411 4.443 20 5 EIBDMO Cc1csc([C@H]2CCC[N@@H+](Cc3ccc(C)c([N+](=O)[O-])c3)C2)n1 ZINC000092788127 1044797710 /nfs/dbraw/zinc/79/77/10/1044797710.db2.gz QBPWPAPRTUMQIK-HNNXBMFYSA-N 1 1 331.441 4.048 20 5 EIBDMO CC(C)C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)CC(C)(C)C ZINC000474231291 1044809575 /nfs/dbraw/zinc/80/95/75/1044809575.db2.gz ZHQDMAMBQKFUOG-UHFFFAOYSA-N 1 1 346.431 4.149 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCCO[C@@H](c3ccccc3)C2)c1 ZINC000735491499 1044832834 /nfs/dbraw/zinc/83/28/34/1044832834.db2.gz IPDZZIVJSLYGDE-GOSISDBHSA-N 1 1 346.814 4.212 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCCO[C@@H](c3ccccc3)C2)c1 ZINC000735491499 1044832837 /nfs/dbraw/zinc/83/28/37/1044832837.db2.gz IPDZZIVJSLYGDE-GOSISDBHSA-N 1 1 346.814 4.212 20 5 EIBDMO CCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H]1CCCCO1 ZINC000735493172 1044832957 /nfs/dbraw/zinc/83/29/57/1044832957.db2.gz WVUPMUCMVDSOQD-OAHLLOKOSA-N 1 1 326.824 4.029 20 5 EIBDMO CCC[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H]1CCCCO1 ZINC000735493172 1044832959 /nfs/dbraw/zinc/83/29/59/1044832959.db2.gz WVUPMUCMVDSOQD-OAHLLOKOSA-N 1 1 326.824 4.029 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC000025360098 1044842117 /nfs/dbraw/zinc/84/21/17/1044842117.db2.gz FURGTYBCNSLRBE-QGZVFWFLSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC000025360098 1044842120 /nfs/dbraw/zinc/84/21/20/1044842120.db2.gz FURGTYBCNSLRBE-QGZVFWFLSA-N 1 1 330.359 4.080 20 5 EIBDMO Cc1cc([C@@H](C)[NH2+]Cc2c(F)cc([N+](=O)[O-])cc2F)c(C)s1 ZINC000508966060 1044847065 /nfs/dbraw/zinc/84/70/65/1044847065.db2.gz VEJCSCWCZZINPX-SECBINFHSA-N 1 1 326.368 4.402 20 5 EIBDMO CC(C)[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CCc1nccs1 ZINC000093764125 1044853298 /nfs/dbraw/zinc/85/32/98/1044853298.db2.gz RCAPVWLOZBMCHD-FNORWQNLSA-N 1 1 331.441 4.018 20 5 EIBDMO C[C@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000736627151 1044960925 /nfs/dbraw/zinc/96/09/25/1044960925.db2.gz CLFIXOWMOIREBE-JSGCOSHPSA-N 1 1 332.350 4.251 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@H]3CCCc4cccnc43)o2)c1 ZINC000922879858 1045019044 /nfs/dbraw/zinc/01/90/44/1045019044.db2.gz DJJDUHZFQONCRV-SFHVURJKSA-N 1 1 349.390 4.417 20 5 EIBDMO CCC[C@@H]([NH2+][C@@H](COC)c1ccc(C)o1)c1cccc([N+](=O)[O-])c1 ZINC000156453305 1045058106 /nfs/dbraw/zinc/05/81/06/1045058106.db2.gz UZQMAOCAXUIHQU-SJORKVTESA-N 1 1 332.400 4.315 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cnn(C(C)C)c1 ZINC000542574579 1045427034 /nfs/dbraw/zinc/42/70/34/1045427034.db2.gz RKCVIHYPJRWAOP-CQSZACIVSA-N 1 1 346.431 4.010 20 5 EIBDMO CCOc1ccc([C@@H](C)[NH2+][C@H](CCOC)c2ccco2)cc1[N+](=O)[O-] ZINC000272487864 1045493234 /nfs/dbraw/zinc/49/32/34/1045493234.db2.gz BXEPPBCZFDCEQQ-UKRRQHHQSA-N 1 1 348.399 4.015 20 5 EIBDMO CCCO[C@H]1CCC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000153874064 1045939572 /nfs/dbraw/zinc/93/95/72/1045939572.db2.gz QAGYMJPXASXMNE-AWEZNQCLSA-N 1 1 326.824 4.029 20 5 EIBDMO COc1ccc(C[C@H](C)[N@H+]2CCc3ccccc3[C@H]2C)c([N+](=O)[O-])c1 ZINC001170327245 1045999020 /nfs/dbraw/zinc/99/90/20/1045999020.db2.gz GILACEBAQFNVAX-LSDHHAIUSA-N 1 1 340.423 4.154 20 5 EIBDMO COc1ccc(C[C@@H](C)[N@@H+](C)C/C=C/c2ccccc2)c([N+](=O)[O-])c1 ZINC001170352816 1046008304 /nfs/dbraw/zinc/00/83/04/1046008304.db2.gz RDIXPLQQYVOFDG-OJXHRBAXSA-N 1 1 340.423 4.180 20 5 EIBDMO COc1ccc(C[C@@H](C)[N@@H+](C)Cc2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC001170343516 1046019432 /nfs/dbraw/zinc/01/94/32/1046019432.db2.gz PVEWFDLLUJNELD-CYBMUJFWSA-N 1 1 348.830 4.320 20 5 EIBDMO COc1ccc(C[C@@H](C)[N@@H+](C)CCc2cccc(C)c2)c([N+](=O)[O-])c1 ZINC001170345256 1046020015 /nfs/dbraw/zinc/02/00/15/1046020015.db2.gz JBUIARYKJFAYSJ-MRXNPFEDSA-N 1 1 342.439 4.017 20 5 EIBDMO Cc1ccc([C@@H](C)[N@H+](C)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000792861253 1046079114 /nfs/dbraw/zinc/07/91/14/1046079114.db2.gz ACZFAUXOEWEMLF-CYBMUJFWSA-N 1 1 329.356 4.004 20 5 EIBDMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000792861253 1046079131 /nfs/dbraw/zinc/07/91/31/1046079131.db2.gz ACZFAUXOEWEMLF-CYBMUJFWSA-N 1 1 329.356 4.004 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CCCCC3CCOCC3)C2)cc1 ZINC001170426059 1046147677 /nfs/dbraw/zinc/14/76/77/1046147677.db2.gz XFSPTVDWQVBRJI-LJQANCHMSA-N 1 1 346.471 4.371 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H]1CCCc2c(O)cccc21 ZINC000192356641 1046230720 /nfs/dbraw/zinc/23/07/20/1046230720.db2.gz LNMPMSXSZMPCKR-OAHLLOKOSA-N 1 1 332.787 4.121 20 5 EIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000536676553 1046660128 /nfs/dbraw/zinc/66/01/28/1046660128.db2.gz SEZQKLSYTZQROJ-GNJLHFKMSA-N 1 1 330.428 4.032 20 5 EIBDMO C[C@@H]1C[C@H](c2cccnc2)[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000805749734 1047000906 /nfs/dbraw/zinc/00/09/06/1047000906.db2.gz QZAATMJFDDWHNN-SJKOYZFVSA-N 1 1 331.803 4.226 20 5 EIBDMO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000805749734 1047000922 /nfs/dbraw/zinc/00/09/22/1047000922.db2.gz QZAATMJFDDWHNN-SJKOYZFVSA-N 1 1 331.803 4.226 20 5 EIBDMO C[N@H+]1CCCC[C@@H]1CCSc1nc2ccc([N+](=O)[O-])cc2s1 ZINC000787999380 1047079304 /nfs/dbraw/zinc/07/93/04/1047079304.db2.gz NQXHSMSDZYRHHR-LLVKDONJSA-N 1 1 337.470 4.171 20 5 EIBDMO C[N@H+](Cc1ccc(C(F)(F)F)cc1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788468777 1047196184 /nfs/dbraw/zinc/19/61/84/1047196184.db2.gz BAWNJDQRDUEOCE-UHFFFAOYSA-N 1 1 342.292 4.385 20 5 EIBDMO C[N@@H+](Cc1ccc(C(F)(F)F)cc1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788468777 1047196191 /nfs/dbraw/zinc/19/61/91/1047196191.db2.gz BAWNJDQRDUEOCE-UHFFFAOYSA-N 1 1 342.292 4.385 20 5 EIBDMO COc1ccccc1C[C@@H]1CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000476241874 1047437125 /nfs/dbraw/zinc/43/71/25/1047437125.db2.gz MFDFBZCJPUHFGP-SFHVURJKSA-N 1 1 340.423 4.119 20 5 EIBDMO C[C@H](N[C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000556132941 1047484796 /nfs/dbraw/zinc/48/47/96/1047484796.db2.gz UWVFVPMGONKCTR-RIFZZMRRSA-N 1 1 339.439 4.081 20 5 EIBDMO C[C@H]([NH2+][C@H]1CCN(C)[C@@H](c2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000556132941 1047484804 /nfs/dbraw/zinc/48/48/04/1047484804.db2.gz UWVFVPMGONKCTR-RIFZZMRRSA-N 1 1 339.439 4.081 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC001170733085 1047879297 /nfs/dbraw/zinc/87/92/97/1047879297.db2.gz PXJBBMIFBMHNIX-GJZGRUSLSA-N 1 1 326.396 4.247 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC001170733085 1047879298 /nfs/dbraw/zinc/87/92/98/1047879298.db2.gz PXJBBMIFBMHNIX-GJZGRUSLSA-N 1 1 326.396 4.247 20 5 EIBDMO Cn1ncc(C[NH2+]Cc2c3ccccc3c(Cl)c3ccccc32)n1 ZINC000808416766 1047898582 /nfs/dbraw/zinc/89/85/82/1047898582.db2.gz MQIWRVSPMJNSDL-UHFFFAOYSA-N 1 1 336.826 4.065 20 5 EIBDMO COc1cccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1OC ZINC000194999583 1047912866 /nfs/dbraw/zinc/91/28/66/1047912866.db2.gz IEBZDADGWRKEJV-UHFFFAOYSA-N 1 1 344.411 4.023 20 5 EIBDMO C[C@H]([NH2+]Cc1cccc(Cl)c1Cl)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815572307 1048534128 /nfs/dbraw/zinc/53/41/28/1048534128.db2.gz ZSARXUFAKVGWGH-VIFPVBQESA-N 1 1 340.210 4.335 20 5 EIBDMO CCOC[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000809946507 1048570559 /nfs/dbraw/zinc/57/05/59/1048570559.db2.gz WTLGILGJUVZCLO-LLVKDONJSA-N 1 1 347.242 4.150 20 5 EIBDMO CCOC[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000809946507 1048570575 /nfs/dbraw/zinc/57/05/75/1048570575.db2.gz WTLGILGJUVZCLO-LLVKDONJSA-N 1 1 347.242 4.150 20 5 EIBDMO CCC[C@]1(CO)CCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809990338 1048591883 /nfs/dbraw/zinc/59/18/83/1048591883.db2.gz RPDUQMIARNNHDH-OAHLLOKOSA-N 1 1 347.242 4.029 20 5 EIBDMO CCC[C@]1(CO)CCC[N@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809990338 1048591897 /nfs/dbraw/zinc/59/18/97/1048591897.db2.gz RPDUQMIARNNHDH-OAHLLOKOSA-N 1 1 347.242 4.029 20 5 EIBDMO Cc1csc([C@@H]2CCC[N@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000195328851 1048653790 /nfs/dbraw/zinc/65/37/90/1048653790.db2.gz VPQOIYZFELTWJW-DZGCQCFKSA-N 1 1 331.441 4.300 20 5 EIBDMO Cc1csc([C@H]2CCC[N@@H+](Cc3cccc([N+](=O)[O-])c3C)C2)n1 ZINC000195322585 1048658149 /nfs/dbraw/zinc/65/81/49/1048658149.db2.gz NRWMSXSGFHQYJT-HNNXBMFYSA-N 1 1 331.441 4.048 20 5 EIBDMO COc1ccc(C[N@H+]2[C@H](C)C[C@H](c3ccccc3)[C@@H]2C)cc1[N+](=O)[O-] ZINC001170638495 1049179947 /nfs/dbraw/zinc/17/99/47/1049179947.db2.gz JGHMKQBZRJTALB-VKJFTORMSA-N 1 1 340.423 4.370 20 5 EIBDMO C[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@H]1CCCC[C@H]1C(F)(F)F ZINC000812881701 1049620398 /nfs/dbraw/zinc/62/03/98/1049620398.db2.gz ARYFVLSRHKHXSE-OCCSQVGLSA-N 1 1 334.313 4.287 20 5 EIBDMO C[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@H]1CCCC[C@H]1C(F)(F)F ZINC000812881701 1049620415 /nfs/dbraw/zinc/62/04/15/1049620415.db2.gz ARYFVLSRHKHXSE-OCCSQVGLSA-N 1 1 334.313 4.287 20 5 EIBDMO CC(C)(C)[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1ccsc1 ZINC001171900382 1049817367 /nfs/dbraw/zinc/81/73/67/1049817367.db2.gz KSUJYAWIAQVFKS-UHFFFAOYSA-N 1 1 334.441 4.336 20 5 EIBDMO CCOc1cc(C[N@H+](Cc2ccc(C)o2)C2CC2)ccc1[N+](=O)[O-] ZINC000617196156 1049965900 /nfs/dbraw/zinc/96/59/00/1049965900.db2.gz XNRCKEPMAJYKOS-UHFFFAOYSA-N 1 1 330.384 4.060 20 5 EIBDMO CCOc1cc(C[N@@H+](Cc2ccc(C)o2)C2CC2)ccc1[N+](=O)[O-] ZINC000617196156 1049965903 /nfs/dbraw/zinc/96/59/03/1049965903.db2.gz XNRCKEPMAJYKOS-UHFFFAOYSA-N 1 1 330.384 4.060 20 5 EIBDMO CCN(CC)[C@H](C[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C)CC(C)C ZINC001177209966 1050162450 /nfs/dbraw/zinc/16/24/50/1050162450.db2.gz URSCQRVGSAKCLN-KRWDZBQOSA-N 1 1 335.492 4.058 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCC[C@@H]1c1ccccn1)CC2 ZINC001172912624 1050244777 /nfs/dbraw/zinc/24/47/77/1050244777.db2.gz BZOGHFRKZPCBKF-FXAWDEMLSA-N 1 1 337.423 4.074 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCC[C@H]1c1ccccn1)CC2 ZINC001172912633 1050245793 /nfs/dbraw/zinc/24/57/93/1050245793.db2.gz BZOGHFRKZPCBKF-XLIONFOSSA-N 1 1 337.423 4.074 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@H](c3ccccc3)C1)CC2 ZINC001172909591 1050246579 /nfs/dbraw/zinc/24/65/79/1050246579.db2.gz TYMRMBWNTLAFGW-VQTJNVASSA-N 1 1 336.435 4.332 20 5 EIBDMO COc1ccccc1[C@H]1CC[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173228975 1050356516 /nfs/dbraw/zinc/35/65/16/1050356516.db2.gz OWXKJYJRCFVPIA-RDJZCZTQSA-N 1 1 340.423 4.024 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCSC[C@H]1c1ccccc1 ZINC001173228397 1050357764 /nfs/dbraw/zinc/35/77/64/1050357764.db2.gz VWJRYGBONXNMDD-BEFAXECRSA-N 1 1 342.464 4.316 20 5 EIBDMO COc1ccc([C@H]2CC[N@H+]([C@H](C)Cc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC001173230756 1050358967 /nfs/dbraw/zinc/35/89/67/1050358967.db2.gz FLLMWHYCTNXUBO-QAPCUYQASA-N 1 1 340.423 4.024 20 5 EIBDMO CC(C)c1nc(C[N@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cs1 ZINC001173231719 1050359055 /nfs/dbraw/zinc/35/90/55/1050359055.db2.gz CMJXSMYNYKDQED-ZDUSSCGKSA-N 1 1 333.457 4.238 20 5 EIBDMO CC(C)c1nc(C[N@@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cs1 ZINC001173231719 1050359060 /nfs/dbraw/zinc/35/90/60/1050359060.db2.gz CMJXSMYNYKDQED-ZDUSSCGKSA-N 1 1 333.457 4.238 20 5 EIBDMO CC(C)c1ncc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)s1 ZINC001178172039 1050408353 /nfs/dbraw/zinc/40/83/53/1050408353.db2.gz VHDZLQYYFDVVAA-UHFFFAOYSA-N 1 1 325.821 4.118 20 5 EIBDMO Cc1ccccc1C[C@@H](C)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000618551773 1050409113 /nfs/dbraw/zinc/40/91/13/1050409113.db2.gz ZWQOFKORSAHUEZ-CQSZACIVSA-N 1 1 339.395 4.107 20 5 EIBDMO CC(C)(C)n1c[nH+]cc1[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2F)C1 ZINC001187903018 1050640337 /nfs/dbraw/zinc/64/03/37/1050640337.db2.gz BQVZIWTXJSUFST-ZDUSSCGKSA-N 1 1 346.406 4.069 20 5 EIBDMO Cc1cccnc1[C@@H](C)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC001179784301 1050778323 /nfs/dbraw/zinc/77/83/23/1050778323.db2.gz GRPMQFYIKBFLLA-CQSZACIVSA-N 1 1 337.379 4.409 20 5 EIBDMO C[N@H+](Cc1cccs1)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001179892477 1050804820 /nfs/dbraw/zinc/80/48/20/1050804820.db2.gz INKWONHQVBMYBI-UHFFFAOYSA-N 1 1 330.331 4.307 20 5 EIBDMO C[N@@H+](Cc1cccs1)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001179892477 1050804829 /nfs/dbraw/zinc/80/48/29/1050804829.db2.gz INKWONHQVBMYBI-UHFFFAOYSA-N 1 1 330.331 4.307 20 5 EIBDMO COc1ccc(CCC[N@@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC001180161917 1050906472 /nfs/dbraw/zinc/90/64/72/1050906472.db2.gz RDVYGMASRLUYIB-UHFFFAOYSA-N 1 1 348.830 4.321 20 5 EIBDMO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1ccc([N+](=O)[O-])cc1C)CCC2 ZINC000183343920 1051096161 /nfs/dbraw/zinc/09/61/61/1051096161.db2.gz FAVBUJIQDVZNGR-MRXNPFEDSA-N 1 1 331.441 4.178 20 5 EIBDMO Cc1ccccc1OCCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC001190417525 1051179171 /nfs/dbraw/zinc/17/91/71/1051179171.db2.gz JZZRKHFUSHABLW-UHFFFAOYSA-N 1 1 328.412 4.113 20 5 EIBDMO COc1cc(C)ccc1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001181880183 1051337404 /nfs/dbraw/zinc/33/74/04/1051337404.db2.gz ONOJZNMRDLSJEX-KRWDZBQOSA-N 1 1 340.423 4.291 20 5 EIBDMO Cc1ccc(C(C)(C)C[N@@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC001191230908 1051404910 /nfs/dbraw/zinc/40/49/10/1051404910.db2.gz AJJWOWRPAUAAQA-UHFFFAOYSA-N 1 1 330.403 4.452 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCS[C@@H]3CCCC[C@H]32)c1 ZINC001191358541 1051429693 /nfs/dbraw/zinc/42/96/93/1051429693.db2.gz MQAKOFAVRDSBIN-HUUCEWRRSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)c1 ZINC001191358541 1051429701 /nfs/dbraw/zinc/42/97/01/1051429701.db2.gz MQAKOFAVRDSBIN-HUUCEWRRSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCS[C@H]3CCCC[C@@H]32)c(Cl)c1 ZINC001191359319 1051441633 /nfs/dbraw/zinc/44/16/33/1051441633.db2.gz UNZRQPIFMHJUOB-GJZGRUSLSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)c(Cl)c1 ZINC001191359319 1051441638 /nfs/dbraw/zinc/44/16/38/1051441638.db2.gz UNZRQPIFMHJUOB-GJZGRUSLSA-N 1 1 326.849 4.108 20 5 EIBDMO CC(C)(C)[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC001192052844 1051625929 /nfs/dbraw/zinc/62/59/29/1051625929.db2.gz NFCBLTAEQVGNDL-UHFFFAOYSA-N 1 1 328.412 4.274 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccccc2F)C2CCC2)cc1F ZINC001192215482 1051667474 /nfs/dbraw/zinc/66/74/74/1051667474.db2.gz URLPGZOOYUWEMC-UHFFFAOYSA-N 1 1 332.350 4.428 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccccc2F)C2CCC2)cc1F ZINC001192215482 1051667480 /nfs/dbraw/zinc/66/74/80/1051667480.db2.gz URLPGZOOYUWEMC-UHFFFAOYSA-N 1 1 332.350 4.428 20 5 EIBDMO C[C@]1(Cc2ccccc2)CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001193071622 1051861913 /nfs/dbraw/zinc/86/19/13/1051861913.db2.gz XQBVUDRKYKBKDE-HXUWFJFHSA-N 1 1 340.423 4.071 20 5 EIBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCC[C@@H]1/C=C/c1ccccc1 ZINC001176639479 1052147649 /nfs/dbraw/zinc/14/76/49/1052147649.db2.gz HNNBBVRHPREXJO-VEGGFIAOSA-N 1 1 326.371 4.412 20 5 EIBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@@H]1/C=C/c1ccccc1 ZINC001176639479 1052147657 /nfs/dbraw/zinc/14/76/57/1052147657.db2.gz HNNBBVRHPREXJO-VEGGFIAOSA-N 1 1 326.371 4.412 20 5 EIBDMO COc1ccc(C[N@@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)cc1Cl ZINC001195225386 1053341520 /nfs/dbraw/zinc/34/15/20/1053341520.db2.gz SIWWBUKWCZSNRV-UHFFFAOYSA-N 1 1 334.803 4.197 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(Cl)c1N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000865486277 1053520993 /nfs/dbraw/zinc/52/09/93/1053520993.db2.gz OUKKWJYPPDRGDB-UHFFFAOYSA-N 1 1 341.198 4.009 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](c3ccccn3)C2)ccc1Cl ZINC000852086891 1053549818 /nfs/dbraw/zinc/54/98/18/1053549818.db2.gz WVYSLUSEPKGWIM-CQSZACIVSA-N 1 1 331.803 4.023 20 5 EIBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC3(CCCC3)[C@@H]2c2ccco2)cc1 ZINC001196003966 1053551481 /nfs/dbraw/zinc/55/14/81/1053551481.db2.gz FLBRPZRGNVWVIJ-SFHVURJKSA-N 1 1 326.396 4.348 20 5 EIBDMO CCC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCc2ccccc21 ZINC000776580321 1053563164 /nfs/dbraw/zinc/56/31/64/1053563164.db2.gz UFFHYEVLTUOMBX-VQTJNVASSA-N 1 1 340.423 4.028 20 5 EIBDMO CC(C)[N@@H+](C)CC1CCN(c2ccc(C(F)F)cc2[N+](=O)[O-])CC1 ZINC000853206709 1053653620 /nfs/dbraw/zinc/65/36/20/1053653620.db2.gz UFRFLNRLYKZXKR-UHFFFAOYSA-N 1 1 341.402 4.089 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1noc3ccc(F)cc31)CCC2 ZINC000866510496 1053757468 /nfs/dbraw/zinc/75/74/68/1053757468.db2.gz DGTLSMJUKISXLB-MRXNPFEDSA-N 1 1 341.342 4.042 20 5 EIBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)C[C@@H](C)C2CCCCC2)c1 ZINC001196820024 1053779665 /nfs/dbraw/zinc/77/96/65/1053779665.db2.gz XAKMWMNBTBOLCA-CQSZACIVSA-N 1 1 348.443 4.030 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCCC[C@H]2C[C@@H](O)c2ccco2)cc1 ZINC000121901062 1053855783 /nfs/dbraw/zinc/85/57/83/1053855783.db2.gz YUBGZGJTXZEFQW-ZWKOTPCHSA-N 1 1 344.411 4.056 20 5 EIBDMO CC(C)(O)C[N@@H+](Cc1ccccc1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000775765414 1053860198 /nfs/dbraw/zinc/86/01/98/1053860198.db2.gz OCJRZXIHYJFIPW-UHFFFAOYSA-N 1 1 348.830 4.021 20 5 EIBDMO Cc1cc(NC[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000301402486 1053870281 /nfs/dbraw/zinc/87/02/81/1053870281.db2.gz DBHHFAZWGOOULM-RDTXWAMCSA-N 1 1 345.468 4.460 20 5 EIBDMO C[C@@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H]1c1ccccc1 ZINC001197661425 1053964008 /nfs/dbraw/zinc/96/40/08/1053964008.db2.gz VOCSBYATLUUCDZ-YJYMSZOUSA-N 1 1 336.395 4.054 20 5 EIBDMO C[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H]1c1ccccc1 ZINC001197661425 1053964017 /nfs/dbraw/zinc/96/40/17/1053964017.db2.gz VOCSBYATLUUCDZ-YJYMSZOUSA-N 1 1 336.395 4.054 20 5 EIBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)NC(C)C ZINC001202528136 1053997831 /nfs/dbraw/zinc/99/78/31/1053997831.db2.gz FAFKXOSDENFTRH-UHFFFAOYSA-N 1 1 336.439 4.292 20 5 EIBDMO Cc1nc2c(s1)[C@@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])CCC2 ZINC000872060204 1054370209 /nfs/dbraw/zinc/37/02/09/1054370209.db2.gz NUZZAHYVFZYDQQ-CABZTGNLSA-N 1 1 335.404 4.227 20 5 EIBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1COCc2ccccc21 ZINC000872079826 1054380292 /nfs/dbraw/zinc/38/02/92/1054380292.db2.gz LCIFEIJNMDJZAO-PXAZEXFGSA-N 1 1 344.436 4.239 20 5 EIBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1COCc2ccccc21 ZINC000872079827 1054381269 /nfs/dbraw/zinc/38/12/69/1054381269.db2.gz LCIFEIJNMDJZAO-SJCJKPOMSA-N 1 1 344.436 4.239 20 5 EIBDMO CC(C)[C@H](O)[C@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000872088753 1054385258 /nfs/dbraw/zinc/38/52/58/1054385258.db2.gz PXLBPUGDRNIMMR-BKTGTZMESA-N 1 1 346.402 4.143 20 5 EIBDMO CC(C)[C@@H](O)[C@@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000872088754 1054385282 /nfs/dbraw/zinc/38/52/82/1054385282.db2.gz PXLBPUGDRNIMMR-FASAQXTFSA-N 1 1 346.402 4.143 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](OC3CCC3)CC2)ccc1Cl ZINC000872260619 1054426767 /nfs/dbraw/zinc/42/67/67/1054426767.db2.gz QDLZWAFNMLUZGD-HNNXBMFYSA-N 1 1 338.835 4.172 20 5 EIBDMO C[C@H]([NH2+]Cc1ccc(OC(F)F)c(F)c1)c1ccccc1[N+](=O)[O-] ZINC000873183424 1054504718 /nfs/dbraw/zinc/50/47/18/1054504718.db2.gz LWGOAZNLFQCAHB-JTQLQIEISA-N 1 1 340.301 4.186 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@@H](c1ccccn1)C1CCC1 ZINC000859564192 1054697915 /nfs/dbraw/zinc/69/79/15/1054697915.db2.gz ZDAQYAKCZHDOCY-QGZVFWFLSA-N 1 1 331.803 4.274 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)cc1 ZINC000776276627 1055144603 /nfs/dbraw/zinc/14/46/03/1055144603.db2.gz LIDZCJWAZIPJGW-MSOLQXFVSA-N 1 1 346.814 4.119 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1NC[C@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000301484953 1055585419 /nfs/dbraw/zinc/58/54/19/1055585419.db2.gz WCARNSIOQNZZFF-RDTXWAMCSA-N 1 1 345.468 4.460 20 5 EIBDMO CC[NH+](CC)[C@H](CNCc1ccc(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000327037039 1055972837 /nfs/dbraw/zinc/97/28/37/1055972837.db2.gz VZJVTLJXTPZBSA-HXUWFJFHSA-N 1 1 341.455 4.076 20 5 EIBDMO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000743855104 1059158443 /nfs/dbraw/zinc/15/84/43/1059158443.db2.gz YQJCMGJTJGRJFP-XIKOKIGWSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000743855104 1059158471 /nfs/dbraw/zinc/15/84/71/1059158471.db2.gz YQJCMGJTJGRJFP-XIKOKIGWSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@H]1C[C@@H](c2ccccc2F)[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000743856136 1059159697 /nfs/dbraw/zinc/15/96/97/1059159697.db2.gz HDDDYOOHGIJFES-SGTLLEGYSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@H]1C[C@@H](c2ccccc2F)[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000743856136 1059159722 /nfs/dbraw/zinc/15/97/22/1059159722.db2.gz HDDDYOOHGIJFES-SGTLLEGYSA-N 1 1 332.350 4.456 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCc2ccccc2Cl)C2CC2)cc1 ZINC001168847789 1060485202 /nfs/dbraw/zinc/48/52/02/1060485202.db2.gz GEKIOHIZIPZZFH-UHFFFAOYSA-N 1 1 330.815 4.455 20 5 EIBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@@H+](CCc2ccccc2)Cc2ccccc2)C1 ZINC001169039305 1060593458 /nfs/dbraw/zinc/59/34/58/1060593458.db2.gz PKYPRGWLLIOVFM-SFTDATJTSA-N 1 1 338.451 4.177 20 5 EIBDMO CC(C)(C)Oc1ccc([C@@H]2CC[N@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)cc1 ZINC001169055822 1060610233 /nfs/dbraw/zinc/61/02/33/1060610233.db2.gz QOGQSFIXGXMLTK-NXHRZFHOSA-N 1 1 346.471 4.099 20 5 EIBDMO CCOc1cc(C[N@H+]2CC[C@H](c3cccc(C)c3)C2)ccc1[N+](=O)[O-] ZINC001169195951 1060680176 /nfs/dbraw/zinc/68/01/76/1060680176.db2.gz AODSCUZABFXIOD-SFHVURJKSA-N 1 1 340.423 4.291 20 5 EIBDMO CC(C)[C@H]1CCC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC001169384412 1060803272 /nfs/dbraw/zinc/80/32/72/1060803272.db2.gz ZHEDTKWWSSADCQ-LBPRGKRZSA-N 1 1 341.249 4.225 20 5 EIBDMO CC(C)[C@H]1CCC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC001169384412 1060803276 /nfs/dbraw/zinc/80/32/76/1060803276.db2.gz ZHEDTKWWSSADCQ-LBPRGKRZSA-N 1 1 341.249 4.225 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000533019993 1032449075 /nfs/dbraw/zinc/44/90/75/1032449075.db2.gz HKCGDLNNDZFLNU-CQSZACIVSA-N 1 1 348.406 4.321 20 5 EIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](CCC(C)C)C1CCCC1 ZINC000533253567 1032569471 /nfs/dbraw/zinc/56/94/71/1032569471.db2.gz BYMKWGKRBIOYCB-UHFFFAOYSA-N 1 1 347.459 4.132 20 5 EIBDMO C[C@H]1CCC[C@H](C)[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000533432026 1032758898 /nfs/dbraw/zinc/75/88/98/1032758898.db2.gz TZNRYTJPZWDBAJ-GJZGRUSLSA-N 1 1 343.427 4.303 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]Cc3ccc(Cl)o3)o2)c1 ZINC000608835486 1019243510 /nfs/dbraw/zinc/24/35/10/1019243510.db2.gz MJSMOGAGQWTTET-UHFFFAOYSA-N 1 1 332.743 4.391 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](C(F)(F)F)C(C)(C)C1 ZINC000430236454 1019553207 /nfs/dbraw/zinc/55/32/07/1019553207.db2.gz AXLWWOHSZKFWMM-AWEZNQCLSA-N 1 1 346.349 4.014 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](C(F)(F)F)C(C)(C)C1 ZINC000430236454 1019553218 /nfs/dbraw/zinc/55/32/18/1019553218.db2.gz AXLWWOHSZKFWMM-AWEZNQCLSA-N 1 1 346.349 4.014 20 5 EIBDMO C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001167226695 1020602495 /nfs/dbraw/zinc/60/24/95/1020602495.db2.gz AAHQJXVDCNQILB-DGCLKSJQSA-N 1 1 341.249 4.368 20 5 EIBDMO Cc1c(C[N@H+]2CCC[C@H]2C[C@H](O)c2cccs2)cccc1[N+](=O)[O-] ZINC000175830588 1021082703 /nfs/dbraw/zinc/08/27/03/1021082703.db2.gz ZENHYIIHRXKSBV-RDJZCZTQSA-N 1 1 346.452 4.053 20 5 EIBDMO Cc1c(C[NH2+][C@@H](c2ccccc2)c2ccccn2)cccc1[N+](=O)[O-] ZINC000076581134 1021093034 /nfs/dbraw/zinc/09/30/34/1021093034.db2.gz GZYZWDVNOKHAJP-FQEVSTJZSA-N 1 1 333.391 4.177 20 5 EIBDMO Cc1ccc2cc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])ccc2n1 ZINC000348639872 1021244264 /nfs/dbraw/zinc/24/42/64/1021244264.db2.gz ZXVZZWKXMZKOBF-UHFFFAOYSA-N 1 1 335.407 4.126 20 5 EIBDMO COc1cccc(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)c1 ZINC000180004867 1021304911 /nfs/dbraw/zinc/30/49/11/1021304911.db2.gz APWMVVPBJCVSOT-NRFANRHFSA-N 1 1 348.402 4.483 20 5 EIBDMO COc1ccc(CNc2ccc([NH+]3CCCCC3)cc2)cc1[N+](=O)[O-] ZINC000102846627 1021316458 /nfs/dbraw/zinc/31/64/58/1021316458.db2.gz JCXLDEIVKXGKRM-UHFFFAOYSA-N 1 1 341.411 4.206 20 5 EIBDMO CC(C)[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCCO1 ZINC000580056404 1021581115 /nfs/dbraw/zinc/58/11/15/1021581115.db2.gz AHDGUVFRHSNVMB-LJQANCHMSA-N 1 1 344.411 4.102 20 5 EIBDMO C[C@]1(c2ccccc2)CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC001167368105 1021767520 /nfs/dbraw/zinc/76/75/20/1021767520.db2.gz VMJJTXMRZPFDEQ-FQEVSTJZSA-N 1 1 340.423 4.027 20 5 EIBDMO CC(C)CCOC1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000178006028 1021855911 /nfs/dbraw/zinc/85/59/11/1021855911.db2.gz LNVBUOLWWACIBY-UHFFFAOYSA-N 1 1 340.851 4.275 20 5 EIBDMO COc1cc(C[NH2+]C2(c3ccc(F)cc3)CCC2)c([N+](=O)[O-])cc1F ZINC000613381668 1021916617 /nfs/dbraw/zinc/91/66/17/1021916617.db2.gz ONACPQZTUXADGE-UHFFFAOYSA-N 1 1 348.349 4.051 20 5 EIBDMO C[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1nc2c(s1)CCC2 ZINC000414159191 1021991901 /nfs/dbraw/zinc/99/19/01/1021991901.db2.gz VSZGHLDTUUPSTO-XHDPSFHLSA-N 1 1 343.452 4.268 20 5 EIBDMO O=[N+]([O-])c1cc(F)ccc1NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000310879500 1022498632 /nfs/dbraw/zinc/49/86/32/1022498632.db2.gz HUGPAMQCTVZINQ-INIZCTEOSA-N 1 1 343.402 4.058 20 5 EIBDMO Cc1cncc(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)c1 ZINC000181030186 1022881836 /nfs/dbraw/zinc/88/18/36/1022881836.db2.gz PKNPNNREVVOZNX-FQEVSTJZSA-N 1 1 333.391 4.177 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H]1CCOc2ccc(F)cc21 ZINC000893866482 1033128809 /nfs/dbraw/zinc/12/88/09/1033128809.db2.gz HZQAYISKKXZVPS-CQSZACIVSA-N 1 1 336.750 4.001 20 5 EIBDMO C[N@H+](Cc1cccc([N+](=O)[O-])c1)C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000051132340 1023468683 /nfs/dbraw/zinc/46/86/83/1023468683.db2.gz AIUASQZZGBFPHP-UYAOXDASSA-N 1 1 340.423 4.195 20 5 EIBDMO O=[N+]([O-])c1cccc(C[NH2+]Cc2nc(-c3ccccc3F)cs2)c1 ZINC000377398507 1023509418 /nfs/dbraw/zinc/50/94/18/1023509418.db2.gz MVANHIJCFQGDSM-UHFFFAOYSA-N 1 1 343.383 4.147 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@](C)(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000500180751 1023571656 /nfs/dbraw/zinc/57/16/56/1023571656.db2.gz NMKMNVCKYCVHHS-FQEVSTJZSA-N 1 1 340.423 4.157 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](Cc3ccccc3)C2)c(Cl)c1 ZINC001167482336 1023695550 /nfs/dbraw/zinc/69/55/50/1023695550.db2.gz JHWPNCVJWRZAMQ-OAHLLOKOSA-N 1 1 330.815 4.313 20 5 EIBDMO Cc1c([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)cnn1C(C)C ZINC000276579072 1023764566 /nfs/dbraw/zinc/76/45/66/1023764566.db2.gz VCIKMOVSVZEHSJ-LLVKDONJSA-N 1 1 336.823 4.185 20 5 EIBDMO C[C@@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])c1cccc(C[NH+](C)C)c1 ZINC000925693124 1023775115 /nfs/dbraw/zinc/77/51/15/1023775115.db2.gz OOGNCZZOUOJRHE-CABCVRRESA-N 1 1 327.428 4.068 20 5 EIBDMO O=[N+]([O-])c1cccc(Br)c1C[N@H+]1CCC2(CCCC2)C1 ZINC001167487225 1023819533 /nfs/dbraw/zinc/81/95/33/1023819533.db2.gz IDKWTZKHKAVVQM-UHFFFAOYSA-N 1 1 339.233 4.123 20 5 EIBDMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000072776094 1023845161 /nfs/dbraw/zinc/84/51/61/1023845161.db2.gz JZISCOJRGMEVCL-XJKSGUPXSA-N 1 1 344.415 4.045 20 5 EIBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)Nc2ccc([N+](=O)[O-])s2)cc1 ZINC000610915067 1023853621 /nfs/dbraw/zinc/85/36/21/1023853621.db2.gz OXQUQYCQKPDTPW-NSHDSACASA-N 1 1 328.397 4.324 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCO[C@H]4CCC[C@H]43)s2)cc1 ZINC000430880629 1024158653 /nfs/dbraw/zinc/15/86/53/1024158653.db2.gz YPSOJFSZLWQXOQ-SJORKVTESA-N 1 1 344.436 4.077 20 5 EIBDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(c2ccsc2[N+](=O)[O-])CC1 ZINC000610786815 1024851551 /nfs/dbraw/zinc/85/15/51/1024851551.db2.gz DCEYQJJCQNQWPT-CQSZACIVSA-N 1 1 337.489 4.137 20 5 EIBDMO C[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc2c(c1)CCCC2 ZINC000610967006 1025172083 /nfs/dbraw/zinc/17/20/83/1025172083.db2.gz ZGVXCWCHNPOQES-ZDUSSCGKSA-N 1 1 328.387 4.464 20 5 EIBDMO COc1cc(C)c(C[N@@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000024802639 1025295525 /nfs/dbraw/zinc/29/55/25/1025295525.db2.gz QLRVPXNYTLTYFY-CQSZACIVSA-N 1 1 344.411 4.113 20 5 EIBDMO CCn1nc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c2ccccc21 ZINC000472037933 1025468089 /nfs/dbraw/zinc/46/80/89/1025468089.db2.gz KZWPOWROWPPWIY-AWEZNQCLSA-N 1 1 338.411 4.124 20 5 EIBDMO CC(C)C[C@H]1CCCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000123686298 1025481460 /nfs/dbraw/zinc/48/14/60/1025481460.db2.gz JVIVJBOLFCVJEE-MRXNPFEDSA-N 1 1 344.415 4.045 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC=C(c3ccc(O)cc3)CC2)c(Cl)c1 ZINC000542000067 1025754508 /nfs/dbraw/zinc/75/45/08/1025754508.db2.gz KWKCKBACNZTELS-UHFFFAOYSA-N 1 1 344.798 4.243 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC=C(c3ccc(O)cc3)CC2)c(Cl)c1 ZINC000542000067 1025754530 /nfs/dbraw/zinc/75/45/30/1025754530.db2.gz KWKCKBACNZTELS-UHFFFAOYSA-N 1 1 344.798 4.243 20 5 EIBDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2cccc([N+](=O)[O-])c2)C12CCCCC2 ZINC001167535352 1025981674 /nfs/dbraw/zinc/98/16/74/1025981674.db2.gz VGHVNPDQFUZIKA-MSOLQXFVSA-N 1 1 332.444 4.155 20 5 EIBDMO CC(C)Oc1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511061419 1026045448 /nfs/dbraw/zinc/04/54/48/1026045448.db2.gz AOHCXBAEDRGRDK-UHFFFAOYSA-N 1 1 328.412 4.057 20 5 EIBDMO CCOc1cc(C[NH+]2CCC(CC(F)(F)F)CC2)ccc1[N+](=O)[O-] ZINC000551708819 1026244331 /nfs/dbraw/zinc/24/43/31/1026244331.db2.gz MZBHQLZUWJERGN-UHFFFAOYSA-N 1 1 346.349 4.158 20 5 EIBDMO C[C@H]1C[C@@H]1c1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)o1 ZINC000030150809 1026253070 /nfs/dbraw/zinc/25/30/70/1026253070.db2.gz CKTASMDEKYBDTB-UGSOOPFHSA-N 1 1 326.396 4.476 20 5 EIBDMO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)o1 ZINC000030150809 1026253078 /nfs/dbraw/zinc/25/30/78/1026253078.db2.gz CKTASMDEKYBDTB-UGSOOPFHSA-N 1 1 326.396 4.476 20 5 EIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@@H](COc2ccccc2)C1 ZINC000507706231 1026882184 /nfs/dbraw/zinc/88/21/84/1026882184.db2.gz GWYQPYMVTCLHPF-BQLWYNFJSA-N 1 1 338.407 4.009 20 5 EIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@@H](COc2ccccc2)C1 ZINC000507706232 1026882574 /nfs/dbraw/zinc/88/25/74/1026882574.db2.gz GWYQPYMVTCLHPF-DBWMJRBXSA-N 1 1 338.407 4.009 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H]2CCCC[C@H]21 ZINC000543907230 1027444201 /nfs/dbraw/zinc/44/42/01/1027444201.db2.gz XNOQVEVQOJNUSC-JEBQAFNWSA-N 1 1 341.411 4.260 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H](C)C[C@H]1c1cccc(F)c1 ZINC000441325894 1027461448 /nfs/dbraw/zinc/46/14/48/1027461448.db2.gz UKVJDOBPDLIDKC-ACJLOTCBSA-N 1 1 344.386 4.326 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](C)C[C@H]1c1cccc(F)c1 ZINC000441325894 1027461458 /nfs/dbraw/zinc/46/14/58/1027461458.db2.gz UKVJDOBPDLIDKC-ACJLOTCBSA-N 1 1 344.386 4.326 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@H]3C3CCCCC3)nc2c1 ZINC000444592077 1027881674 /nfs/dbraw/zinc/88/16/74/1027881674.db2.gz OUQWFVBUNXPINN-KRWDZBQOSA-N 1 1 328.416 4.016 20 5 EIBDMO CC(C)[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1cccc(F)c1 ZINC000444597041 1027881945 /nfs/dbraw/zinc/88/19/45/1027881945.db2.gz LVBDMPILHWWLMN-UHFFFAOYSA-N 1 1 342.374 4.021 20 5 EIBDMO CC(C)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1cccc(F)c1 ZINC000444597041 1027881950 /nfs/dbraw/zinc/88/19/50/1027881950.db2.gz LVBDMPILHWWLMN-UHFFFAOYSA-N 1 1 342.374 4.021 20 5 EIBDMO Cc1cccc(N2CC[NH+]([C@@H](C)c3ccccc3[N+](=O)[O-])CC2)c1C ZINC000439555431 1027900546 /nfs/dbraw/zinc/90/05/46/1027900546.db2.gz BXKKLRNFWDPIDI-KRWDZBQOSA-N 1 1 339.439 4.095 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H](C)c1cc(C)ccc1C ZINC000523439212 1028115506 /nfs/dbraw/zinc/11/55/06/1028115506.db2.gz OCSODBGZFMMWEG-OAHLLOKOSA-N 1 1 328.412 4.413 20 5 EIBDMO CCOc1ccc([C@@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000523702014 1028324841 /nfs/dbraw/zinc/32/48/41/1028324841.db2.gz SJYSMCBLILHTCD-FQEVSTJZSA-N 1 1 340.423 4.373 20 5 EIBDMO CC(C)(O)C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC1 ZINC000428412181 1028794709 /nfs/dbraw/zinc/79/47/09/1028794709.db2.gz KZBAWMAUIJHXEK-UHFFFAOYSA-N 1 1 346.452 4.059 20 5 EIBDMO CC1(C)CCCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000446059495 1029117909 /nfs/dbraw/zinc/11/79/09/1029117909.db2.gz FLFLBHFPGVNTKJ-UHFFFAOYSA-N 1 1 343.427 4.304 20 5 EIBDMO C[C@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000523008762 1029366500 /nfs/dbraw/zinc/36/65/00/1029366500.db2.gz BGWWIUVELLLCKN-YOEHRIQHSA-N 1 1 328.387 4.154 20 5 EIBDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2csc([N+](=O)[O-])c2)C12CCCCC2 ZINC000525126727 1029465585 /nfs/dbraw/zinc/46/55/85/1029465585.db2.gz LHFNUHIWYVMVNG-CABCVRRESA-N 1 1 338.473 4.216 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+]Cc2ccc(Cl)nc2Cl)cc1[N+](=O)[O-] ZINC000278646871 1029645190 /nfs/dbraw/zinc/64/51/90/1029645190.db2.gz PMTILRSYVLXGPO-JTQLQIEISA-N 1 1 340.210 4.456 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCN(c2cccc(Cl)c2)CC1 ZINC000441164537 1029652522 /nfs/dbraw/zinc/65/25/22/1029652522.db2.gz GJFKEHQWPYYDDP-AWEZNQCLSA-N 1 1 345.830 4.131 20 5 EIBDMO CC(C)c1ccc(C[N@@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000584323635 1029736717 /nfs/dbraw/zinc/73/67/17/1029736717.db2.gz XVTBHMZLYUZJKU-RBUKOAKNSA-N 1 1 344.455 4.252 20 5 EIBDMO CC(C)c1ccc(C[N@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000584323635 1029736724 /nfs/dbraw/zinc/73/67/24/1029736724.db2.gz XVTBHMZLYUZJKU-RBUKOAKNSA-N 1 1 344.455 4.252 20 5 EIBDMO CC(C)c1noc([C@H](C)[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451546439 1030562922 /nfs/dbraw/zinc/56/29/22/1030562922.db2.gz JHXMZEOAFRGECE-DZGCQCFKSA-N 1 1 344.415 4.042 20 5 EIBDMO CC(C)c1noc([C@H](C)[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451546439 1030562941 /nfs/dbraw/zinc/56/29/41/1030562941.db2.gz JHXMZEOAFRGECE-DZGCQCFKSA-N 1 1 344.415 4.042 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3nc(C4CC4)cs3)C2)cc1 ZINC000451546365 1030564858 /nfs/dbraw/zinc/56/48/58/1030564858.db2.gz JCBFXZKKXPZONN-OAHLLOKOSA-N 1 1 343.452 4.308 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3nc(C4CC4)cs3)C2)cc1 ZINC000451546365 1030564882 /nfs/dbraw/zinc/56/48/82/1030564882.db2.gz JCBFXZKKXPZONN-OAHLLOKOSA-N 1 1 343.452 4.308 20 5 EIBDMO CCCc1nc(C)c(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000451554468 1030571776 /nfs/dbraw/zinc/57/17/76/1030571776.db2.gz ZVYQAZVAEVYISY-INIZCTEOSA-N 1 1 343.427 4.223 20 5 EIBDMO CC(C)(C)[C@H]1CCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000532578030 1031311607 /nfs/dbraw/zinc/31/16/07/1031311607.db2.gz OINSKJVGADIJQT-QGZVFWFLSA-N 1 1 343.427 4.303 20 5 EIBDMO O=[N+]([O-])c1cccc(C[NH2+][C@H]2CCCc3cn(C4CCCC4)nc32)c1 ZINC000375832792 1031322496 /nfs/dbraw/zinc/32/24/96/1031322496.db2.gz QXEZEJHIBBYNEX-SFHVURJKSA-N 1 1 340.427 4.074 20 5 EIBDMO C[C@H]([NH2+][C@@H]1CCc2cc(F)c(F)c(F)c21)c1ccccc1[N+](=O)[O-] ZINC000449200941 1031543324 /nfs/dbraw/zinc/54/33/24/1031543324.db2.gz FXDFUJZFVQBXDB-TVQRCGJNSA-N 1 1 336.313 4.350 20 5 EIBDMO CC(C)COC[C@@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1ccco1 ZINC000236621122 1031571483 /nfs/dbraw/zinc/57/14/83/1031571483.db2.gz UTDWUKIQKBMNFL-ZGRWHYIRSA-N 1 1 344.411 4.205 20 5 EIBDMO COC[C@]1(C)CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000449398810 1031702351 /nfs/dbraw/zinc/70/23/51/1031702351.db2.gz YZFXNSSNGJRUPB-GOSISDBHSA-N 1 1 346.452 4.182 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3csc(C4CC4)n3)C2)cc1 ZINC000449502973 1031811814 /nfs/dbraw/zinc/81/18/14/1031811814.db2.gz SKIMFSUCZWQXCW-HNNXBMFYSA-N 1 1 343.452 4.308 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3csc(C4CC4)n3)C2)cc1 ZINC000449502973 1031811819 /nfs/dbraw/zinc/81/18/19/1031811819.db2.gz SKIMFSUCZWQXCW-HNNXBMFYSA-N 1 1 343.452 4.308 20 5 EIBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1(C)C ZINC000449506689 1031815300 /nfs/dbraw/zinc/81/53/00/1031815300.db2.gz ZKMOMGKESLLEMT-GOSISDBHSA-N 1 1 344.411 4.102 20 5 EIBDMO CC1(C)C[C@H]([NH2+][C@H]2COc3ccc(F)cc32)c2cc([N+](=O)[O-])ccc21 ZINC000433231543 1034080273 /nfs/dbraw/zinc/08/02/73/1034080273.db2.gz KKMGGEQTSAMAEA-IRXDYDNUSA-N 1 1 342.370 4.180 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1CSc2ccccc21 ZINC000595009905 1035505617 /nfs/dbraw/zinc/50/56/17/1035505617.db2.gz UJFUXUGFVJEIQM-IAQYHMDHSA-N 1 1 330.409 4.101 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1CCCOc2ccccc21 ZINC000595036692 1035561741 /nfs/dbraw/zinc/56/17/41/1035561741.db2.gz KMSWWIJSASKVBD-GUYCJALGSA-N 1 1 342.395 4.168 20 5 EIBDMO CC[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC)c1c(C)noc1C ZINC000595035765 1035561831 /nfs/dbraw/zinc/56/18/31/1035561831.db2.gz MFGKLJIKANYQNP-MEBBXXQBSA-N 1 1 333.388 4.010 20 5 EIBDMO CCC[C@@H]([NH2+]Cc1c(OC)cccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000595075788 1035593423 /nfs/dbraw/zinc/59/34/23/1035593423.db2.gz YUYQNUJNXUIIRL-QGZVFWFLSA-N 1 1 344.411 4.243 20 5 EIBDMO CCc1nc2c(s1)[C@@H]([N@H+](C)Cc1ccc(F)cc1[N+](=O)[O-])CCC2 ZINC000595382000 1035670147 /nfs/dbraw/zinc/67/01/47/1035670147.db2.gz AWVBIDCPNVMTRT-AWEZNQCLSA-N 1 1 349.431 4.262 20 5 EIBDMO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-])CCC2 ZINC000595382000 1035670159 /nfs/dbraw/zinc/67/01/59/1035670159.db2.gz AWVBIDCPNVMTRT-AWEZNQCLSA-N 1 1 349.431 4.262 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2nc3c(s2)CCC3)cc1[N+](=O)[O-] ZINC000502016864 1035808015 /nfs/dbraw/zinc/80/80/15/1035808015.db2.gz LGNFSHKLKBJJCG-RYUDHWBXSA-N 1 1 331.441 4.260 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1cc2ccncc2s1)C1CC1 ZINC000596979750 1036063638 /nfs/dbraw/zinc/06/36/38/1036063638.db2.gz NGZNSWAJVVZKES-UHFFFAOYSA-N 1 1 339.420 4.369 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cc2ccncc2s1)C1CC1 ZINC000596979750 1036063659 /nfs/dbraw/zinc/06/36/59/1036063659.db2.gz NGZNSWAJVVZKES-UHFFFAOYSA-N 1 1 339.420 4.369 20 5 EIBDMO COc1cc(C[N@H+]2CCC[C@@H]2c2ccccc2C)ccc1[N+](=O)[O-] ZINC000485746961 1036238004 /nfs/dbraw/zinc/23/80/04/1036238004.db2.gz USYLFFHSUOJQSB-QGZVFWFLSA-N 1 1 326.396 4.249 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@@H](C)c1cccc(OC)c1 ZINC000485801834 1036282677 /nfs/dbraw/zinc/28/26/77/1036282677.db2.gz QVEQJJFLQQBWET-AWEZNQCLSA-N 1 1 344.411 4.195 20 5 EIBDMO COc1cc(C[N@@H+](C)[C@H]2CC[C@@H](C(F)(F)F)CC2)ccc1[N+](=O)[O-] ZINC000588982433 1036632838 /nfs/dbraw/zinc/63/28/38/1036632838.db2.gz ATWGAJCNHRGGAP-BETUJISGSA-N 1 1 346.349 4.156 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](c2ccc3cccnc3n2)C1 ZINC000602886118 1036659631 /nfs/dbraw/zinc/65/96/31/1036659631.db2.gz HBOVWDSAJKYDTE-GOEBONIOSA-N 1 1 348.406 4.089 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](c2ccc3cccnc3n2)C1 ZINC000602888763 1036660843 /nfs/dbraw/zinc/66/08/43/1036660843.db2.gz RCUBUGXLDQZFBA-RHSMWYFYSA-N 1 1 348.406 4.089 20 5 EIBDMO COc1ccc(F)c(C[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)c1 ZINC000598650020 1036737289 /nfs/dbraw/zinc/73/72/89/1036737289.db2.gz XCLCYEBPDJSLSB-UHFFFAOYSA-N 1 1 332.375 4.156 20 5 EIBDMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000486780496 1036851135 /nfs/dbraw/zinc/85/11/35/1036851135.db2.gz VMPZCYFKJDFLQR-CJNGLKHVSA-N 1 1 344.415 4.045 20 5 EIBDMO CC[N@H+](Cc1ccoc1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000590157670 1036992794 /nfs/dbraw/zinc/99/27/94/1036992794.db2.gz ACOFRDOEDMYZRB-UHFFFAOYSA-N 1 1 328.290 4.229 20 5 EIBDMO CC[N@@H+](Cc1ccoc1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000590157670 1036992833 /nfs/dbraw/zinc/99/28/33/1036992833.db2.gz ACOFRDOEDMYZRB-UHFFFAOYSA-N 1 1 328.290 4.229 20 5 EIBDMO COc1ccc(C[N@H+](C)[C@@H](C)c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000603841142 1037033644 /nfs/dbraw/zinc/03/36/44/1037033644.db2.gz KHOWJPBWCKEJNA-NSHDSACASA-N 1 1 336.338 4.075 20 5 EIBDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000603841142 1037033658 /nfs/dbraw/zinc/03/36/58/1037033658.db2.gz KHOWJPBWCKEJNA-NSHDSACASA-N 1 1 336.338 4.075 20 5 EIBDMO Cc1c(C[N@@H+](C)CCOc2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000603843692 1037036099 /nfs/dbraw/zinc/03/60/99/1037036099.db2.gz UGFVTJVGRVSMJR-UHFFFAOYSA-N 1 1 334.803 4.067 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCCCc1ccccc1 ZINC000603854574 1037047898 /nfs/dbraw/zinc/04/78/98/1037047898.db2.gz FNZHNHITBDORKF-UHFFFAOYSA-N 1 1 328.412 4.058 20 5 EIBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CC=C(c3c[nH]c4ccccc34)CC2)cc1 ZINC000603872027 1037066290 /nfs/dbraw/zinc/06/62/90/1037066290.db2.gz PXQCOLYGPUYGNR-UHFFFAOYSA-N 1 1 347.418 4.408 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@H](c2ccccn2)C1 ZINC000590599986 1037115125 /nfs/dbraw/zinc/11/51/25/1037115125.db2.gz INPBYQXFNFVGBK-HZPDHXFCSA-N 1 1 325.412 4.239 20 5 EIBDMO COc1cc(C)c(C[N@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000487583076 1037161384 /nfs/dbraw/zinc/16/13/84/1037161384.db2.gz ITHVDRITLOQXOS-CQSZACIVSA-N 1 1 344.411 4.113 20 5 EIBDMO COc1cc(C)c(C[N@@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000487583076 1037161393 /nfs/dbraw/zinc/16/13/93/1037161393.db2.gz ITHVDRITLOQXOS-CQSZACIVSA-N 1 1 344.411 4.113 20 5 EIBDMO Cc1nc(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)cs1 ZINC000604539179 1037434455 /nfs/dbraw/zinc/43/44/55/1037434455.db2.gz SSESJMHPBGCJFL-UHFFFAOYSA-N 1 1 345.449 4.378 20 5 EIBDMO Cc1ccnc([C@@H]2CC[N@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)c1 ZINC000594004973 1038186100 /nfs/dbraw/zinc/18/61/00/1038186100.db2.gz REHVRUYTECAMTD-HZPDHXFCSA-N 1 1 325.412 4.157 20 5 EIBDMO COC[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000490071491 1038332424 /nfs/dbraw/zinc/33/24/24/1038332424.db2.gz KFEITRCDBMQGGC-KRWDZBQOSA-N 1 1 334.803 4.068 20 5 EIBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@H]1CC=CCC1 ZINC001168405436 1038388610 /nfs/dbraw/zinc/38/86/10/1038388610.db2.gz YPDAPHYACZQBQD-LBPRGKRZSA-N 1 1 328.334 4.402 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccnc(Oc2ccccc2)c1 ZINC000608781948 1038898063 /nfs/dbraw/zinc/89/80/63/1038898063.db2.gz KBOLPDITNDBTDP-UHFFFAOYSA-N 1 1 335.363 4.072 20 5 EIBDMO C[C@@H]1CC[C@H](C)C[N@@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000537619622 1038953367 /nfs/dbraw/zinc/95/33/67/1038953367.db2.gz HQHFWUWTEWNRTK-QWHCGFSZSA-N 1 1 331.441 4.339 20 5 EIBDMO CC(C)CC(C)(C)C[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000552062206 1039083789 /nfs/dbraw/zinc/08/37/89/1039083789.db2.gz PKIDUZRQSLQBBS-QGZVFWFLSA-N 1 1 344.459 4.080 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000430105868 1039847726 /nfs/dbraw/zinc/84/77/26/1039847726.db2.gz OVJDESJKJRXZDP-XATQLNLPSA-N 1 1 337.423 4.476 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000430105868 1039847728 /nfs/dbraw/zinc/84/77/28/1039847728.db2.gz OVJDESJKJRXZDP-XATQLNLPSA-N 1 1 337.423 4.476 20 5 EIBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccc(OC(F)F)cc1 ZINC000505616025 1040100605 /nfs/dbraw/zinc/10/06/05/1040100605.db2.gz YCZSVZSTQWOKEL-GQCTYLIASA-N 1 1 348.349 4.341 20 5 EIBDMO CCC[C@@H]1CCC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC001167958587 1040265380 /nfs/dbraw/zinc/26/53/80/1040265380.db2.gz KFBOHZQWQJMONI-GFCCVEGCSA-N 1 1 341.249 4.369 20 5 EIBDMO CCC[C@@H]1CCC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC001167958587 1040265392 /nfs/dbraw/zinc/26/53/92/1040265392.db2.gz KFBOHZQWQJMONI-GFCCVEGCSA-N 1 1 341.249 4.369 20 5 EIBDMO CCC[C@H]1CCC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC001167958588 1040266127 /nfs/dbraw/zinc/26/61/27/1040266127.db2.gz KFBOHZQWQJMONI-LBPRGKRZSA-N 1 1 341.249 4.369 20 5 EIBDMO CCC[C@H]1CCC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC001167958588 1040266143 /nfs/dbraw/zinc/26/61/43/1040266143.db2.gz KFBOHZQWQJMONI-LBPRGKRZSA-N 1 1 341.249 4.369 20 5 EIBDMO CCCOc1ccc(C(C)(C)NCc2cc([O-])ccc2[N+](=O)[O-])cc1 ZINC000515314513 1040660262 /nfs/dbraw/zinc/66/02/62/1040660262.db2.gz BSFFWCFTIFWLES-UHFFFAOYSA-N 1 1 344.411 4.114 20 5 EIBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CCC(C)(C)C1 ZINC000483106995 1040701732 /nfs/dbraw/zinc/70/17/32/1040701732.db2.gz CHPKFQIFKUEBIJ-INIZCTEOSA-N 1 1 343.427 4.303 20 5 EIBDMO C[C@@H](O)C[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000539828622 1040822499 /nfs/dbraw/zinc/82/24/99/1040822499.db2.gz FGJNXXVXICONTJ-KGLIPLIRSA-N 1 1 346.452 4.059 20 5 EIBDMO COC1CCC([N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000539839889 1040833749 /nfs/dbraw/zinc/83/37/49/1040833749.db2.gz CBCNOOFIJGQTCL-UHFFFAOYSA-N 1 1 344.411 4.244 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000515552885 1040851429 /nfs/dbraw/zinc/85/14/29/1040851429.db2.gz QJTXHGWWUNBOCD-QGZVFWFLSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000515552885 1040851435 /nfs/dbraw/zinc/85/14/35/1040851435.db2.gz QJTXHGWWUNBOCD-QGZVFWFLSA-N 1 1 330.359 4.080 20 5 EIBDMO CC[C@H]1CC[C@H](C)[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000540055685 1041077963 /nfs/dbraw/zinc/07/79/63/1041077963.db2.gz KARZZHQZLLMPKP-ZFWWWQNUSA-N 1 1 329.400 4.055 20 5 EIBDMO C[C@H](NC[C@H]1CCC[N@H+]1C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000436310526 1041097231 /nfs/dbraw/zinc/09/72/31/1041097231.db2.gz RMNMNECFZPGYJX-HNAYVOBHSA-N 1 1 331.460 4.043 20 5 EIBDMO C[C@@H](NC[C@H]1CCC[N@H+]1C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000436310525 1041097808 /nfs/dbraw/zinc/09/78/08/1041097808.db2.gz RMNMNECFZPGYJX-DNVCBOLYSA-N 1 1 331.460 4.043 20 5 EIBDMO Cc1ccc(C[N@@H+]2CC[C@@H](Oc3ccccc3Cl)C2)cc1[N+](=O)[O-] ZINC001168362858 1041247924 /nfs/dbraw/zinc/24/79/24/1041247924.db2.gz SQCLMXKXLNHWMR-OAHLLOKOSA-N 1 1 346.814 4.210 20 5 EIBDMO Cc1ccc(C[N@H+]2CC[C@@H](Oc3ccccc3Cl)C2)cc1[N+](=O)[O-] ZINC001168362858 1041247939 /nfs/dbraw/zinc/24/79/39/1041247939.db2.gz SQCLMXKXLNHWMR-OAHLLOKOSA-N 1 1 346.814 4.210 20 5 EIBDMO Cc1c(C[NH2+]Cc2csc(-c3cccs3)n2)cccc1[N+](=O)[O-] ZINC000480445029 1041304247 /nfs/dbraw/zinc/30/42/47/1041304247.db2.gz NKYMHVGLHAIYJS-UHFFFAOYSA-N 1 1 345.449 4.378 20 5 EIBDMO Cc1noc(C[N@@H+](CCc2ccccc2F)C2CCCC2)c1[N+](=O)[O-] ZINC000595297547 1041463387 /nfs/dbraw/zinc/46/33/87/1041463387.db2.gz VYZKKBNEXBWRPR-UHFFFAOYSA-N 1 1 347.390 4.018 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCO[C@@](C)(c2ccccc2)C1 ZINC000538709455 1041482935 /nfs/dbraw/zinc/48/29/35/1041482935.db2.gz PVYOBXFOVRRDSJ-OXJNMPFZSA-N 1 1 340.423 4.212 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCO[C@@](C)(c2ccccc2)C1 ZINC000538709455 1041482936 /nfs/dbraw/zinc/48/29/36/1041482936.db2.gz PVYOBXFOVRRDSJ-OXJNMPFZSA-N 1 1 340.423 4.212 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](Cc1cccc(-c3cccnc3)c1)CC2 ZINC000538729361 1041502361 /nfs/dbraw/zinc/50/23/61/1041502361.db2.gz KBZMHLSQWQWDQM-UHFFFAOYSA-N 1 1 345.402 4.215 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1cccc(-c3cccnc3)c1)CC2 ZINC000538729361 1041502376 /nfs/dbraw/zinc/50/23/76/1041502376.db2.gz KBZMHLSQWQWDQM-UHFFFAOYSA-N 1 1 345.402 4.215 20 5 EIBDMO COc1cc(C[NH+]2CCC(c3ccccc3)CC2)c([N+](=O)[O-])cc1F ZINC000463474252 1041579757 /nfs/dbraw/zinc/57/97/57/1041579757.db2.gz OANJZBLNHAOHFF-UHFFFAOYSA-N 1 1 344.386 4.122 20 5 EIBDMO COc1cc(C[N@@H+](Cc2ccccc2)C(C)C)c([N+](=O)[O-])cc1F ZINC000463481374 1041590244 /nfs/dbraw/zinc/59/02/44/1041590244.db2.gz CXOYFIPJTUEIQR-UHFFFAOYSA-N 1 1 332.375 4.153 20 5 EIBDMO C[C@@H](CC(F)(F)F)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000463718296 1041718087 /nfs/dbraw/zinc/71/80/87/1041718087.db2.gz YPPJRTPQCVBOCX-VIFPVBQESA-N 1 1 345.346 4.149 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+](CCC(F)(F)F)CC1CC1 ZINC000437493291 1041821216 /nfs/dbraw/zinc/82/12/16/1041821216.db2.gz FPJORWHZGCREOE-UHFFFAOYSA-N 1 1 336.741 4.413 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+](CCC(F)(F)F)CC1CC1 ZINC000437493291 1041821220 /nfs/dbraw/zinc/82/12/20/1041821220.db2.gz FPJORWHZGCREOE-UHFFFAOYSA-N 1 1 336.741 4.413 20 5 EIBDMO COc1cccc([C@@H]2C[C@H](C)C[N@@H+]2Cc2csc([N+](=O)[O-])c2)c1 ZINC000541320197 1041892190 /nfs/dbraw/zinc/89/21/90/1041892190.db2.gz HEXHKLCFDIMTEP-LRDDRELGSA-N 1 1 332.425 4.248 20 5 EIBDMO COc1cccc([C@@H]2C[C@H](C)C[N@H+]2Cc2csc([N+](=O)[O-])c2)c1 ZINC000541320197 1041892194 /nfs/dbraw/zinc/89/21/94/1041892194.db2.gz HEXHKLCFDIMTEP-LRDDRELGSA-N 1 1 332.425 4.248 20 5 EIBDMO C[C@H](CN[C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)C[NH+](C)C ZINC000425944922 1042033165 /nfs/dbraw/zinc/03/31/65/1042033165.db2.gz ZEYJNUSTYKLPDO-KGLIPLIRSA-N 1 1 347.484 4.172 20 5 EIBDMO C[C@H](C[NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)CN(C)C ZINC000425944922 1042033167 /nfs/dbraw/zinc/03/31/67/1042033167.db2.gz ZEYJNUSTYKLPDO-KGLIPLIRSA-N 1 1 347.484 4.172 20 5 EIBDMO C[C@@H](NC[C@H](C)C[NH+](C)C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000425944923 1042033747 /nfs/dbraw/zinc/03/37/47/1042033747.db2.gz ZEYJNUSTYKLPDO-UONOGXRCSA-N 1 1 347.484 4.172 20 5 EIBDMO C[C@@H]([NH2+]C[C@H](C)CN(C)C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000425944923 1042033752 /nfs/dbraw/zinc/03/37/52/1042033752.db2.gz ZEYJNUSTYKLPDO-UONOGXRCSA-N 1 1 347.484 4.172 20 5 EIBDMO C[C@@H]1C[C@H](C)CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000443647015 1042215287 /nfs/dbraw/zinc/21/52/87/1042215287.db2.gz DCKFXUUDWJZZCP-HUUCEWRRSA-N 1 1 343.427 4.160 20 5 EIBDMO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ccc([N+](=O)[O-])cc1C)CCC2 ZINC000518011852 1042311897 /nfs/dbraw/zinc/31/18/97/1042311897.db2.gz VXTQDDXGXHAEFU-INIZCTEOSA-N 1 1 345.468 4.432 20 5 EIBDMO CCC[N@@H+](C)Cc1cc(OC)c(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000506442123 1042431165 /nfs/dbraw/zinc/43/11/65/1042431165.db2.gz BGSNPJZPEDRPBA-UHFFFAOYSA-N 1 1 344.411 4.024 20 5 EIBDMO CCOc1cc(C[N@@H+](C)[C@@H]2CC[C@H](SCC)C2)ccc1[N+](=O)[O-] ZINC000492776073 1042747155 /nfs/dbraw/zinc/74/71/55/1042747155.db2.gz TZRWPXUVUQTXML-CABCVRRESA-N 1 1 338.473 4.100 20 5 EIBDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000761507029 1042872531 /nfs/dbraw/zinc/87/25/31/1042872531.db2.gz RHGFMVUKJITZCJ-GFCCVEGCSA-N 1 1 334.803 4.450 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000520597110 1042919520 /nfs/dbraw/zinc/91/95/20/1042919520.db2.gz VROFOJLMUOEYDY-QGZVFWFLSA-N 1 1 340.423 4.372 20 5 EIBDMO CCOc1cc(C[N@@H+](C)Cc2cccc3[nH]ccc32)ccc1[N+](=O)[O-] ZINC000494076395 1043014764 /nfs/dbraw/zinc/01/47/64/1043014764.db2.gz AESDKRXHBNJNIK-UHFFFAOYSA-N 1 1 339.395 4.107 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H](c1ccccc1)C(C)C ZINC000303567920 1043071418 /nfs/dbraw/zinc/07/14/18/1043071418.db2.gz XZUHXPLSCHPVFG-LJQANCHMSA-N 1 1 328.412 4.433 20 5 EIBDMO C[C@@H](CCO)[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542976470 1043208050 /nfs/dbraw/zinc/20/80/50/1043208050.db2.gz YUNJNDDWFHFVRR-AWEZNQCLSA-N 1 1 348.830 4.021 20 5 EIBDMO C[C@@H](CCO)[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542976470 1043208056 /nfs/dbraw/zinc/20/80/56/1043208056.db2.gz YUNJNDDWFHFVRR-AWEZNQCLSA-N 1 1 348.830 4.021 20 5 EIBDMO COc1cc(C[N@@H+](C)C/C(C)=C/c2ccccc2)ccc1[N+](=O)[O-] ZINC000494232559 1043375200 /nfs/dbraw/zinc/37/52/00/1043375200.db2.gz BFWNFWDVADMZRA-RVDMUPIBSA-N 1 1 326.396 4.139 20 5 EIBDMO C[C@H]([N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C(C)(C)C ZINC000609193921 1043443562 /nfs/dbraw/zinc/44/35/62/1043443562.db2.gz HGHHQVLTOUURNV-ZDUSSCGKSA-N 1 1 331.416 4.159 20 5 EIBDMO Cc1nc(C)c([C@@H](C)[N@@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])s1 ZINC000255417590 1043468693 /nfs/dbraw/zinc/46/86/93/1043468693.db2.gz LGNGVWOBHYHUGD-FNOHHLHBSA-N 1 1 331.441 4.374 20 5 EIBDMO CC(C)[C@H](c1ccccc1)[N@@H+](C)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000732979042 1044056979 /nfs/dbraw/zinc/05/69/79/1044056979.db2.gz CJGBZLZDCJTUPM-LJQANCHMSA-N 1 1 338.411 4.231 20 5 EIBDMO C[C@@H]1C[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@H]1c1ccccc1 ZINC000245895304 1044204927 /nfs/dbraw/zinc/20/49/27/1044204927.db2.gz PDRIEQVUHULFMD-AUUYWEPGSA-N 1 1 349.390 4.443 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@H]1c1ccccc1 ZINC000245895304 1044204942 /nfs/dbraw/zinc/20/49/42/1044204942.db2.gz PDRIEQVUHULFMD-AUUYWEPGSA-N 1 1 349.390 4.443 20 5 EIBDMO CCC[C@]1(C)CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000174453451 1044274090 /nfs/dbraw/zinc/27/40/90/1044274090.db2.gz MQCYOVOFYZZWJY-GOSISDBHSA-N 1 1 344.415 4.047 20 5 EIBDMO COc1ccc(OC)c([C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000078991269 1044377062 /nfs/dbraw/zinc/37/70/62/1044377062.db2.gz BDIGCJATYZHNLB-CHWSQXEVSA-N 1 1 330.384 4.024 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]Cc3ccccc3)cs2)c1 ZINC000113312767 1044443443 /nfs/dbraw/zinc/44/34/43/1044443443.db2.gz ACGUNKKBLZGRJQ-UHFFFAOYSA-N 1 1 325.393 4.008 20 5 EIBDMO CC(C)[N@@H+](Cc1scnc1C1CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000495080432 1044650159 /nfs/dbraw/zinc/65/01/59/1044650159.db2.gz QLXWWTSXOPANFJ-UHFFFAOYSA-N 1 1 331.441 4.339 20 5 EIBDMO CC[C@H]([NH2+]Cc1c(Cl)cccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000323405084 1044763701 /nfs/dbraw/zinc/76/37/01/1044763701.db2.gz VBOLPVLXMKZPKW-INIZCTEOSA-N 1 1 334.803 4.498 20 5 EIBDMO C[C@@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@H](c2ccco2)C1 ZINC000464858282 1044802270 /nfs/dbraw/zinc/80/22/70/1044802270.db2.gz OMBFQHGFHCWWLV-ZBFHGGJFSA-N 1 1 330.384 4.040 20 5 EIBDMO COc1ccc([C@H](C)[N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000735492100 1044832081 /nfs/dbraw/zinc/83/20/81/1044832081.db2.gz UMUSUKRPNBECFM-LBPRGKRZSA-N 1 1 334.803 4.450 20 5 EIBDMO COc1ccc([C@H](C)[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000735492100 1044832082 /nfs/dbraw/zinc/83/20/82/1044832082.db2.gz UMUSUKRPNBECFM-LBPRGKRZSA-N 1 1 334.803 4.450 20 5 EIBDMO CC[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)Cc1ccccn1 ZINC000093338778 1044832413 /nfs/dbraw/zinc/83/24/13/1044832413.db2.gz MVFUSXPZEYVBHK-UHFFFAOYSA-N 1 1 337.379 4.272 20 5 EIBDMO CC[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)Cc1ccccn1 ZINC000093338778 1044832414 /nfs/dbraw/zinc/83/24/14/1044832414.db2.gz MVFUSXPZEYVBHK-UHFFFAOYSA-N 1 1 337.379 4.272 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)c1 ZINC000735491923 1044832478 /nfs/dbraw/zinc/83/24/78/1044832478.db2.gz PTZNBGLLLVQASJ-QGZVFWFLSA-N 1 1 332.787 4.291 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)c1 ZINC000735491923 1044832483 /nfs/dbraw/zinc/83/24/83/1044832483.db2.gz PTZNBGLLLVQASJ-QGZVFWFLSA-N 1 1 332.787 4.291 20 5 EIBDMO CC[C@@H]1C[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCS1 ZINC000093501949 1044840385 /nfs/dbraw/zinc/84/03/85/1044840385.db2.gz FGANMHDZBXFPBU-OAHLLOKOSA-N 1 1 349.481 4.046 20 5 EIBDMO CC[C@@H]1C[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCS1 ZINC000093501949 1044840389 /nfs/dbraw/zinc/84/03/89/1044840389.db2.gz FGANMHDZBXFPBU-OAHLLOKOSA-N 1 1 349.481 4.046 20 5 EIBDMO Cc1ccc(C[N@H+]2CC[C@H](C(F)(F)F)C3(CCC3)C2)cc1[N+](=O)[O-] ZINC000555349759 1044891768 /nfs/dbraw/zinc/89/17/68/1044891768.db2.gz WFKZIQNSPBHTLL-HNNXBMFYSA-N 1 1 342.361 4.458 20 5 EIBDMO Cc1ccc(C[NH2+][C@H](C)c2nc3c(s2)CCCC3)cc1[N+](=O)[O-] ZINC000736355517 1044928999 /nfs/dbraw/zinc/92/89/99/1044928999.db2.gz QABQVHYIXJELRL-GFCCVEGCSA-N 1 1 331.441 4.089 20 5 EIBDMO Cc1cc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c(C)s1 ZINC000284027771 1045129059 /nfs/dbraw/zinc/12/90/59/1045129059.db2.gz IFSPHCAKCVNBFL-JTQLQIEISA-N 1 1 335.385 4.032 20 5 EIBDMO Cc1ccc(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)[nH+]c1 ZINC000157462152 1045151461 /nfs/dbraw/zinc/15/14/61/1045151461.db2.gz ONSBHSYGFZPDAC-UHFFFAOYSA-N 1 1 326.381 4.034 20 5 EIBDMO Cc1[nH+]ccn1-c1ccc(CNc2cccc(C)c2[N+](=O)[O-])cc1F ZINC000302474756 1045180567 /nfs/dbraw/zinc/18/05/67/1045180567.db2.gz DSIUYBULNRCWQP-UHFFFAOYSA-N 1 1 340.358 4.149 20 5 EIBDMO C[NH+](C)[C@@H](CNc1sccc1[N+](=O)[O-])c1ccccc1Cl ZINC000611411019 1045304097 /nfs/dbraw/zinc/30/40/97/1045304097.db2.gz KJWHNUQFXWLRAW-ZDUSSCGKSA-N 1 1 325.821 4.025 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCCC[C@@H]3c3ccccc3)nc2c1 ZINC000762631775 1045320018 /nfs/dbraw/zinc/32/00/18/1045320018.db2.gz GEKNQROYFOXEKW-QGZVFWFLSA-N 1 1 337.379 4.463 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCCC[C@@H]3c3ccccc3)nc2c1 ZINC000762631775 1045320023 /nfs/dbraw/zinc/32/00/23/1045320023.db2.gz GEKNQROYFOXEKW-QGZVFWFLSA-N 1 1 337.379 4.463 20 5 EIBDMO CCOC(=O)CC[C@H]1CCC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000611516769 1045321179 /nfs/dbraw/zinc/32/11/79/1045321179.db2.gz WDUSORJMHCZAKJ-HZPDHXFCSA-N 1 1 348.443 4.020 20 5 EIBDMO Cc1c(C[NH2+][C@H](c2ccccc2)c2cccnc2)cccc1[N+](=O)[O-] ZINC000790695331 1045559845 /nfs/dbraw/zinc/55/98/45/1045559845.db2.gz NLGLEQPFGRAAHY-HXUWFJFHSA-N 1 1 333.391 4.177 20 5 EIBDMO Cc1cc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cnc1Cl ZINC000768336934 1045792967 /nfs/dbraw/zinc/79/29/67/1045792967.db2.gz CBQHFDAQNBGFQG-UHFFFAOYSA-N 1 1 333.819 4.362 20 5 EIBDMO CCOc1ccc([C@@H](C)[NH2+][C@H](C)c2c(C)noc2C)cc1[N+](=O)[O-] ZINC000153789884 1045842375 /nfs/dbraw/zinc/84/23/75/1045842375.db2.gz NBBJSWVQZNDHSP-GHMZBOCLSA-N 1 1 333.388 4.010 20 5 EIBDMO CCCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1CCCC[C@H]1OC ZINC001170290675 1045993368 /nfs/dbraw/zinc/99/33/68/1045993368.db2.gz PHINEIJQELVRIV-QZTJIDSGSA-N 1 1 338.423 4.294 20 5 EIBDMO COc1ccc(C[C@@H](C)[N@H+]2CC[C@@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001170327155 1045998868 /nfs/dbraw/zinc/99/88/68/1045998868.db2.gz FFELGILYTVCCJR-CRAIPNDOSA-N 1 1 340.423 4.024 20 5 EIBDMO COc1ccc(C[C@@H](C)[N@@H+](C)CCc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC001170348557 1046024420 /nfs/dbraw/zinc/02/44/20/1046024420.db2.gz YKJHQOUBTXTIHN-MRXNPFEDSA-N 1 1 342.439 4.017 20 5 EIBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)[C@H](c1ccccc1)N(C)C ZINC000769930535 1046114727 /nfs/dbraw/zinc/11/47/27/1046114727.db2.gz LDXZCTXEBQBGAP-FZKQIMNGSA-N 1 1 347.846 4.029 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1cccc(OC(C)C)c1 ZINC000533768926 1046395617 /nfs/dbraw/zinc/39/56/17/1046395617.db2.gz UAXKKTCOCGYOIZ-UHFFFAOYSA-N 1 1 344.411 4.023 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1cccc(OC(C)C)c1 ZINC000533768926 1046395627 /nfs/dbraw/zinc/39/56/27/1046395627.db2.gz UAXKKTCOCGYOIZ-UHFFFAOYSA-N 1 1 344.411 4.023 20 5 EIBDMO CC[C@H](c1cccc(OC)c1)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC001170027841 1046440452 /nfs/dbraw/zinc/44/04/52/1046440452.db2.gz VJNSWEVDAOADFG-LJQANCHMSA-N 1 1 328.412 4.229 20 5 EIBDMO CCOc1ccc([C@H]2CCC[N@@H+]2Cc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000916987343 1046525654 /nfs/dbraw/zinc/52/56/54/1046525654.db2.gz FPKXRTBFHDMVTH-GOSISDBHSA-N 1 1 344.386 4.470 20 5 EIBDMO CCOc1ccc([C@H]2CCC[N@H+]2Cc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000916987343 1046525676 /nfs/dbraw/zinc/52/56/76/1046525676.db2.gz FPKXRTBFHDMVTH-GOSISDBHSA-N 1 1 344.386 4.470 20 5 EIBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)CC1(O)CCCC1 ZINC000536667714 1046620352 /nfs/dbraw/zinc/62/03/52/1046620352.db2.gz MRGGKUJDGQGBCX-UHFFFAOYSA-N 1 1 346.452 4.060 20 5 EIBDMO CC[N@H+]1CC[C@H](N(C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C[C@H]1C ZINC000536659980 1046628990 /nfs/dbraw/zinc/62/89/90/1046628990.db2.gz QNQDMKRBRJGWBH-WBVHZDCISA-N 1 1 333.476 4.023 20 5 EIBDMO Cc1ccccc1[C@@H]1CCC[N@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000917481991 1046901468 /nfs/dbraw/zinc/90/14/68/1046901468.db2.gz ASGLGRDEMFZTMG-IBGZPJMESA-N 1 1 336.395 4.048 20 5 EIBDMO COc1ccc([C@H](C)[N@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000746656310 1046925788 /nfs/dbraw/zinc/92/57/88/1046925788.db2.gz XHYGCGVTXJARQO-LBPRGKRZSA-N 1 1 334.803 4.450 20 5 EIBDMO COc1ccc([C@H](C)[N@@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000746656310 1046925801 /nfs/dbraw/zinc/92/58/01/1046925801.db2.gz XHYGCGVTXJARQO-LBPRGKRZSA-N 1 1 334.803 4.450 20 5 EIBDMO C[C@H](Nc1ccc([NH+]2CCCCC2)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788690871 1047262779 /nfs/dbraw/zinc/26/27/79/1047262779.db2.gz MJHGNJASEYTPNV-AWEZNQCLSA-N 1 1 340.427 4.340 20 5 EIBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000537468150 1047398602 /nfs/dbraw/zinc/39/86/02/1047398602.db2.gz WIPBWVSECHRJGX-GOSISDBHSA-N 1 1 332.444 4.109 20 5 EIBDMO C[C@H](N[C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000556057307 1047420467 /nfs/dbraw/zinc/42/04/67/1047420467.db2.gz BDCLPSJVDWJVSO-CVAIRZPRSA-N 1 1 339.439 4.081 20 5 EIBDMO C[C@H](N[C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000556057307 1047420472 /nfs/dbraw/zinc/42/04/72/1047420472.db2.gz BDCLPSJVDWJVSO-CVAIRZPRSA-N 1 1 339.439 4.081 20 5 EIBDMO CCc1ccc[nH+]c1NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000537491126 1047572378 /nfs/dbraw/zinc/57/23/78/1047572378.db2.gz KVTAMDDFNQLQJE-UHFFFAOYSA-N 1 1 340.408 4.288 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC001170733099 1047885657 /nfs/dbraw/zinc/88/56/57/1047885657.db2.gz PXJBBMIFBMHNIX-LSDHHAIUSA-N 1 1 326.396 4.247 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC001170733099 1047885661 /nfs/dbraw/zinc/88/56/61/1047885661.db2.gz PXJBBMIFBMHNIX-LSDHHAIUSA-N 1 1 326.396 4.247 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@H](CC4CC4)C3)cs2)c1 ZINC000556958326 1048320215 /nfs/dbraw/zinc/32/02/15/1048320215.db2.gz CMJQNNFHBSACPW-CQSZACIVSA-N 1 1 343.452 4.340 20 5 EIBDMO C[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1nc2ccccc2s1 ZINC000815580140 1048521177 /nfs/dbraw/zinc/52/11/77/1048521177.db2.gz CQMHXYITDHWJMP-WDEREUQCSA-N 1 1 342.424 4.199 20 5 EIBDMO COC1CCC([N@@H+](C)Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000809948158 1048577659 /nfs/dbraw/zinc/57/76/59/1048577659.db2.gz WHEXOANMSSWDBB-UHFFFAOYSA-N 1 1 347.242 4.291 20 5 EIBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)[C@@H]1CCOC(C)(C)C1 ZINC000810043997 1048605665 /nfs/dbraw/zinc/60/56/65/1048605665.db2.gz VUWRPJFLGFVTQM-CQSZACIVSA-N 1 1 326.824 4.028 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCc2sccc2C1 ZINC000609323431 1048862035 /nfs/dbraw/zinc/86/20/35/1048862035.db2.gz JONFATKOWDOATI-UHFFFAOYSA-N 1 1 346.452 4.392 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCc2sccc2C1 ZINC000609323431 1048862041 /nfs/dbraw/zinc/86/20/41/1048862041.db2.gz JONFATKOWDOATI-UHFFFAOYSA-N 1 1 346.452 4.392 20 5 EIBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]Cc1ccc(F)c(F)c1 ZINC000811475647 1049097295 /nfs/dbraw/zinc/09/72/95/1049097295.db2.gz JEVVGPVGRDDDMS-UHFFFAOYSA-N 1 1 347.148 4.470 20 5 EIBDMO COc1ccc(C[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C2CC2)cc1 ZINC000609704755 1049276714 /nfs/dbraw/zinc/27/67/14/1049276714.db2.gz FZEGKKXQSDNGDM-UHFFFAOYSA-N 1 1 346.814 4.421 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C2CC2)cc1 ZINC000609704755 1049276734 /nfs/dbraw/zinc/27/67/34/1049276734.db2.gz FZEGKKXQSDNGDM-UHFFFAOYSA-N 1 1 346.814 4.421 20 5 EIBDMO Cc1ccc([C@H]2CSCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000609706052 1049277957 /nfs/dbraw/zinc/27/79/57/1049277957.db2.gz PGZUKWQVSYIJOQ-GOSISDBHSA-N 1 1 328.437 4.193 20 5 EIBDMO Cc1ccc([C@H]2CSCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000609706052 1049277972 /nfs/dbraw/zinc/27/79/72/1049277972.db2.gz PGZUKWQVSYIJOQ-GOSISDBHSA-N 1 1 328.437 4.193 20 5 EIBDMO COc1ccc(C[N@@H+](C)[C@H](C)Cc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000609915921 1049393691 /nfs/dbraw/zinc/39/36/91/1049393691.db2.gz WVUCLVRSFIOAMT-CYBMUJFWSA-N 1 1 348.830 4.320 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812849774 1049610216 /nfs/dbraw/zinc/61/02/16/1049610216.db2.gz JEEYNBKZLMOOTF-SCLBCKFNSA-N 1 1 348.830 4.192 20 5 EIBDMO CC[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812849302 1049610914 /nfs/dbraw/zinc/61/09/14/1049610914.db2.gz NHJVYLGTGWDZDL-SCLBCKFNSA-N 1 1 348.830 4.192 20 5 EIBDMO Cc1ccc(C[N@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)nc1 ZINC000616152059 1049855396 /nfs/dbraw/zinc/85/53/96/1049855396.db2.gz HWJGEXRKDLLUFR-UHFFFAOYSA-N 1 1 337.379 4.190 20 5 EIBDMO Cc1ccc(C[N@@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)nc1 ZINC000616152059 1049855400 /nfs/dbraw/zinc/85/54/00/1049855400.db2.gz HWJGEXRKDLLUFR-UHFFFAOYSA-N 1 1 337.379 4.190 20 5 EIBDMO Cc1ccc(C[N@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)nc1 ZINC000616152029 1049855438 /nfs/dbraw/zinc/85/54/38/1049855438.db2.gz BIBUVTFJLLKYHU-UHFFFAOYSA-N 1 1 337.379 4.190 20 5 EIBDMO Cc1ccc(C[N@@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)nc1 ZINC000616152029 1049855439 /nfs/dbraw/zinc/85/54/39/1049855439.db2.gz BIBUVTFJLLKYHU-UHFFFAOYSA-N 1 1 337.379 4.190 20 5 EIBDMO CCOC[C@@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC001171026899 1049871819 /nfs/dbraw/zinc/87/18/19/1049871819.db2.gz VSHRRBRQYFSSLQ-AWEZNQCLSA-N 1 1 346.349 4.005 20 5 EIBDMO CCOC[C@@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC001171026899 1049871823 /nfs/dbraw/zinc/87/18/23/1049871823.db2.gz VSHRRBRQYFSSLQ-AWEZNQCLSA-N 1 1 346.349 4.005 20 5 EIBDMO C[NH+](C)[C@@H](CNc1ccc(F)cc1[N+](=O)[O-])c1ccccc1Cl ZINC000068836936 1049921191 /nfs/dbraw/zinc/92/11/91/1049921191.db2.gz GJWQGRBTPKDCMD-INIZCTEOSA-N 1 1 337.782 4.102 20 5 EIBDMO C[C@H]1CCC[C@H]([N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000170909073 1050105948 /nfs/dbraw/zinc/10/59/48/1050105948.db2.gz XVUNWWJJTOHDPM-HOCLYGCPSA-N 1 1 343.427 4.303 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCCC3(CC(F)C3)CC1)CC2 ZINC001172921339 1050233205 /nfs/dbraw/zinc/23/32/05/1050233205.db2.gz OWSHEAMFUBEBDY-QPIRBTGLSA-N 1 1 346.446 4.446 20 5 EIBDMO C[N@@H+](Cc1cccc(F)c1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172910403 1050246260 /nfs/dbraw/zinc/24/62/60/1050246260.db2.gz ZBVHCXNHJQGQLF-SFHVURJKSA-N 1 1 328.387 4.113 20 5 EIBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@H]2c2ccccc2)c1F ZINC001173196512 1050340048 /nfs/dbraw/zinc/34/00/48/1050340048.db2.gz NEFRFKAKRQPRGC-BBRMVZONSA-N 1 1 344.386 4.121 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC001173231748 1050358866 /nfs/dbraw/zinc/35/88/66/1050358866.db2.gz CWUNUTPISLMGRX-WMLDXEAASA-N 1 1 328.387 4.154 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2cccc(Cl)c2C1 ZINC001173231490 1050359016 /nfs/dbraw/zinc/35/90/16/1050359016.db2.gz LNKWWTMHWIJZFY-ZDUSSCGKSA-N 1 1 330.815 4.238 20 5 EIBDMO CC[N@@H+](CCc1ccc(OC)cc1)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173233813 1050363511 /nfs/dbraw/zinc/36/35/11/1050363511.db2.gz ZAADQRUIEKWJSL-MRXNPFEDSA-N 1 1 342.439 4.099 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@@H]1COc3c1cccc3Cl)CCC2 ZINC000618572018 1050412651 /nfs/dbraw/zinc/41/26/51/1050412651.db2.gz IJVSWVOZXSNTBN-DLBZAZTESA-N 1 1 344.798 4.349 20 5 EIBDMO Cc1ccc(C[N@H+]2CC[C@H](Nc3ccc(Cl)cc3[N+](=O)[O-])C2)cc1 ZINC001187393400 1050540226 /nfs/dbraw/zinc/54/02/26/1050540226.db2.gz YRRZWYLLTJJUPY-INIZCTEOSA-N 1 1 345.830 4.243 20 5 EIBDMO C[C@@H]([NH2+]Cc1cc(Cl)cc2c1OCC2)c1ccccc1[N+](=O)[O-] ZINC001179511694 1050716923 /nfs/dbraw/zinc/71/69/23/1050716923.db2.gz FCZHIORHXPODTR-LLVKDONJSA-N 1 1 332.787 4.034 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC=C(c2ccc(F)cc2)CC1 ZINC000619501780 1050801990 /nfs/dbraw/zinc/80/19/90/1050801990.db2.gz XJKKRCUGKLIDGK-UHFFFAOYSA-N 1 1 342.370 4.032 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC=C(c2ccc(F)cc2)CC1 ZINC000619501780 1050801996 /nfs/dbraw/zinc/80/19/96/1050801996.db2.gz XJKKRCUGKLIDGK-UHFFFAOYSA-N 1 1 342.370 4.032 20 5 EIBDMO CCO[C@@H]1C[C@H]([N@@H+](C)C/C(C)=C/c2cccc([N+](=O)[O-])c2)C12CCC2 ZINC001180132862 1050880534 /nfs/dbraw/zinc/88/05/34/1050880534.db2.gz NROXLBCEIQWAHL-YOYDVCCWSA-N 1 1 344.455 4.278 20 5 EIBDMO CC[C@@](C)([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 ZINC000775390602 1051193568 /nfs/dbraw/zinc/19/35/68/1051193568.db2.gz OJHSQNIVGPYCRX-GOSISDBHSA-N 1 1 325.368 4.151 20 5 EIBDMO CC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1ccc(Cl)cc1 ZINC001190628462 1051238575 /nfs/dbraw/zinc/23/85/75/1051238575.db2.gz ZFBQLVCQWKVSDW-UHFFFAOYSA-N 1 1 334.803 4.149 20 5 EIBDMO COc1cc(C[NH2+][C@@]2(c3ccccc3)CC2(C)C)c([N+](=O)[O-])cc1F ZINC001174906833 1051241210 /nfs/dbraw/zinc/24/12/10/1051241210.db2.gz CIDPMLLUAKFIOJ-LJQANCHMSA-N 1 1 344.386 4.158 20 5 EIBDMO Cc1n[nH]c(C)c1[C@@H]1CCCCC[N@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC001181524512 1051244996 /nfs/dbraw/zinc/24/49/96/1051244996.db2.gz BOJVDGYSRZHDJC-SFHVURJKSA-N 1 1 342.443 4.360 20 5 EIBDMO CCC(CC)CCC[N@@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001174947342 1051269799 /nfs/dbraw/zinc/26/97/99/1051269799.db2.gz AUZVSLOLWDESLB-AWEZNQCLSA-N 1 1 335.448 4.070 20 5 EIBDMO C[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000183710940 1051309734 /nfs/dbraw/zinc/30/97/34/1051309734.db2.gz BBDHNQQGUUCTSM-AWEZNQCLSA-N 1 1 337.379 4.443 20 5 EIBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC001181858917 1051329787 /nfs/dbraw/zinc/32/97/87/1051329787.db2.gz FBPHWXBQHRENPN-TXEJJXNPSA-N 1 1 328.334 4.236 20 5 EIBDMO Cc1ccc(C[NH2+]C2(c3c(F)cccc3F)CCC2)cc1[N+](=O)[O-] ZINC001175103417 1051351866 /nfs/dbraw/zinc/35/18/66/1051351866.db2.gz JHPRFJWJBHAXFB-UHFFFAOYSA-N 1 1 332.350 4.350 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCCCC[C@@H]1CC(C)C ZINC001191112788 1051353779 /nfs/dbraw/zinc/35/37/79/1051353779.db2.gz PYTCUEPGDVMXBM-MRXNPFEDSA-N 1 1 347.459 4.132 20 5 EIBDMO C[C@@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@H](c2ccco2)C1 ZINC001191212862 1051387712 /nfs/dbraw/zinc/38/77/12/1051387712.db2.gz DAAMLNLHMNCYKF-QAPCUYQASA-N 1 1 344.411 4.430 20 5 EIBDMO C[C@H]1C[C@@H](C(C)(C)C)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC001182182850 1051412917 /nfs/dbraw/zinc/41/29/17/1051412917.db2.gz FTUVYVUGUJIMKH-STQMWFEESA-N 1 1 331.416 4.383 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC001192626777 1051783682 /nfs/dbraw/zinc/78/36/82/1051783682.db2.gz OUGULMBNDQMUDY-LLVKDONJSA-N 1 1 349.774 4.316 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](Cc2nccs2)C1 ZINC001184264505 1051981125 /nfs/dbraw/zinc/98/11/25/1051981125.db2.gz DPKHMSBLYXLXBW-IHWMJMDHSA-N 1 1 343.452 4.019 20 5 EIBDMO C[C@@H]1C[C@@H](c2ccccc2)[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC001194153150 1052088681 /nfs/dbraw/zinc/08/86/81/1052088681.db2.gz MPCYCBAVWFORTL-XIKOKIGWSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@@H]1C[C@@H](c2ccccc2)[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC001194153150 1052088689 /nfs/dbraw/zinc/08/86/89/1052088689.db2.gz MPCYCBAVWFORTL-XIKOKIGWSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@@H](CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1 ZINC001184839437 1052114259 /nfs/dbraw/zinc/11/42/59/1052114259.db2.gz IXXDHQLMLKPSLI-NEPJUHHUSA-N 1 1 345.365 4.146 20 5 EIBDMO C[C@H](CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1 ZINC001184839438 1052115070 /nfs/dbraw/zinc/11/50/70/1052115070.db2.gz IXXDHQLMLKPSLI-NWDGAFQWSA-N 1 1 345.365 4.146 20 5 EIBDMO C[C@@H]1CCC[N@@H+](CCCCNc2ncc([N+](=O)[O-])c3ccccc32)C1 ZINC001184873256 1052123120 /nfs/dbraw/zinc/12/31/20/1052123120.db2.gz ADTUECQYGFHFRV-OAHLLOKOSA-N 1 1 342.443 4.067 20 5 EIBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001185037856 1052158605 /nfs/dbraw/zinc/15/86/05/1052158605.db2.gz XMSQSYFEEQPQTM-XJKSGUPXSA-N 1 1 345.830 4.496 20 5 EIBDMO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000774824451 1052172529 /nfs/dbraw/zinc/17/25/29/1052172529.db2.gz NJGMJNCHBGBWRO-LBPRGKRZSA-N 1 1 334.803 4.416 20 5 EIBDMO CCC[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Br ZINC001176776775 1052189819 /nfs/dbraw/zinc/18/98/19/1052189819.db2.gz APJKDORKABDRFG-LBPRGKRZSA-N 1 1 327.222 4.122 20 5 EIBDMO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083133429 1052832191 /nfs/dbraw/zinc/83/21/91/1052832191.db2.gz QEERRBPVAWPEKG-JTQLQIEISA-N 1 1 347.321 4.207 20 5 EIBDMO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083133429 1052832194 /nfs/dbraw/zinc/83/21/94/1052832194.db2.gz QEERRBPVAWPEKG-JTQLQIEISA-N 1 1 347.321 4.207 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@H]2COc2ccccc2)c1 ZINC001194682477 1053071033 /nfs/dbraw/zinc/07/10/33/1053071033.db2.gz CCUBDQKLDDZSPD-INIZCTEOSA-N 1 1 346.814 4.292 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@H]2COc2ccccc2)c1 ZINC001194682477 1053071039 /nfs/dbraw/zinc/07/10/39/1053071039.db2.gz CCUBDQKLDDZSPD-INIZCTEOSA-N 1 1 346.814 4.292 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@@H](c2ccccn2)C1 ZINC000852087648 1053550038 /nfs/dbraw/zinc/55/00/38/1053550038.db2.gz OXBJRJJAEVSOKF-CYBMUJFWSA-N 1 1 331.803 4.023 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@@H](c2ccccn2)C1 ZINC000852087648 1053550049 /nfs/dbraw/zinc/55/00/49/1053550049.db2.gz OXBJRJJAEVSOKF-CYBMUJFWSA-N 1 1 331.803 4.023 20 5 EIBDMO CCCC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccc(C)o1 ZINC000776579608 1053564202 /nfs/dbraw/zinc/56/42/02/1053564202.db2.gz NZKHNCYLYJXMTK-YJBOKZPZSA-N 1 1 346.427 4.393 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC([C@H]3CCCCO3)CC2)c1 ZINC000852595938 1053594733 /nfs/dbraw/zinc/59/47/33/1053594733.db2.gz WHJPYOLBFIFASX-QGZVFWFLSA-N 1 1 338.835 4.029 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@@H]([C@@H]3CCCCO3)C2)c1 ZINC000852596379 1053595488 /nfs/dbraw/zinc/59/54/88/1053595488.db2.gz LHLYVIYHZCBXEM-DYVFJYSZSA-N 1 1 338.835 4.029 20 5 EIBDMO COC[C@@H](C)[N@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1CCc2ccccc21 ZINC001196646026 1053710627 /nfs/dbraw/zinc/71/06/27/1053710627.db2.gz FKNNJLXVDOKOEM-CXAGYDPISA-N 1 1 346.452 4.181 20 5 EIBDMO COC[C@@H](C)[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1CCc2ccccc21 ZINC001196646026 1053710639 /nfs/dbraw/zinc/71/06/39/1053710639.db2.gz FKNNJLXVDOKOEM-CXAGYDPISA-N 1 1 346.452 4.181 20 5 EIBDMO C[C@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1ccns1 ZINC001203307278 1053727041 /nfs/dbraw/zinc/72/70/41/1053727041.db2.gz PFWOUBZTXUQAFT-NSHDSACASA-N 1 1 329.381 4.162 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1noc3ccc(F)cc31)CCC2 ZINC000866510494 1053759221 /nfs/dbraw/zinc/75/92/21/1053759221.db2.gz DGTLSMJUKISXLB-INIZCTEOSA-N 1 1 341.342 4.042 20 5 EIBDMO CC(C)c1cc([C@@H]2CCC[N@H+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)[nH]n1 ZINC001197542354 1053933642 /nfs/dbraw/zinc/93/36/42/1053933642.db2.gz KQKADVBJKJEQIZ-HUUCEWRRSA-N 1 1 342.443 4.382 20 5 EIBDMO CC(C)c1cc([C@@H]2CCC[N@@H+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)n[nH]1 ZINC001197542354 1053933656 /nfs/dbraw/zinc/93/36/56/1053933656.db2.gz KQKADVBJKJEQIZ-HUUCEWRRSA-N 1 1 342.443 4.382 20 5 EIBDMO CC(C)c1cc([C@@H]2CCC[N@H+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)n[nH]1 ZINC001197542354 1053933657 /nfs/dbraw/zinc/93/36/57/1053933657.db2.gz KQKADVBJKJEQIZ-HUUCEWRRSA-N 1 1 342.443 4.382 20 5 EIBDMO CCc1noc(CC)c1C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872042593 1054356709 /nfs/dbraw/zinc/35/67/09/1054356709.db2.gz QFHZSBXZIMAEQH-LLVKDONJSA-N 1 1 349.456 4.280 20 5 EIBDMO CCCNc1ccc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872065491 1054375433 /nfs/dbraw/zinc/37/54/33/1054375433.db2.gz CEPCJRYYAXNEDO-ZDUSSCGKSA-N 1 1 331.391 4.407 20 5 EIBDMO C[N@H+]1CCC[C@H](CNc2c(F)cccc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000553080534 1054850384 /nfs/dbraw/zinc/85/03/84/1054850384.db2.gz NNLRJDHUMWGOQO-PXAZEXFGSA-N 1 1 349.431 4.290 20 5 EIBDMO Cc1csc([C@H]2CC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)n1 ZINC000877813933 1055128600 /nfs/dbraw/zinc/12/86/00/1055128600.db2.gz QHOXAHIAQCIGCM-LBPRGKRZSA-N 1 1 337.832 4.003 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)cc1 ZINC000776276629 1055144419 /nfs/dbraw/zinc/14/44/19/1055144419.db2.gz LIDZCJWAZIPJGW-QZTJIDSGSA-N 1 1 346.814 4.119 20 5 EIBDMO CC[C@H](C)[C@H](C)[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000878057915 1055182126 /nfs/dbraw/zinc/18/21/26/1055182126.db2.gz RDQKAGGDKYZORV-STQMWFEESA-N 1 1 344.415 4.044 20 5 EIBDMO CC(C)CC[C@H]1CCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878199567 1055205979 /nfs/dbraw/zinc/20/59/79/1055205979.db2.gz CUMLDSJUGZFWJI-CQSZACIVSA-N 1 1 344.415 4.045 20 5 EIBDMO C[N@H+]1CCC[C@@H](CNc2ccc(F)cc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000301452236 1055354930 /nfs/dbraw/zinc/35/49/30/1055354930.db2.gz XSKIKSHZIURAJH-YVEFUNNKSA-N 1 1 349.431 4.290 20 5 EIBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)Nc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000301507806 1055646823 /nfs/dbraw/zinc/64/68/23/1055646823.db2.gz AHJHHIFHNBQYAW-LBPRGKRZSA-N 1 1 340.358 4.401 20 5 EIBDMO CC[C@H]([NH2+][C@@H]1CCCc2cn(C(C)C)nc21)c1cccc([N+](=O)[O-])c1 ZINC000765821233 1055653249 /nfs/dbraw/zinc/65/32/49/1055653249.db2.gz NLIQQPPWALNLRR-ZWKOTPCHSA-N 1 1 342.443 4.491 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1CCCc2cn(C(C)C)nc21 ZINC000765822229 1055751497 /nfs/dbraw/zinc/75/14/97/1055751497.db2.gz ZFKYTSGHINGXFR-KDOFPFPSSA-N 1 1 342.443 4.409 20 5 EIBDMO Cc1c([C@H](C)[NH2+][C@H]2c3ccc(F)cc3O[C@@H]2C)cccc1[N+](=O)[O-] ZINC000554089419 1056009761 /nfs/dbraw/zinc/00/97/61/1056009761.db2.gz YDFRCRKJYRWANP-VNBZBWLYSA-N 1 1 330.359 4.215 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+](C[C@@H]2CCCO2)C2CCCC2)c1 ZINC000743851891 1059156903 /nfs/dbraw/zinc/15/69/03/1059156903.db2.gz GWAAZAKTPJOBON-INIZCTEOSA-N 1 1 338.835 4.172 20 5 EIBDMO C[C@@H]1C[C@H](c2ccccc2F)[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000743856135 1059160802 /nfs/dbraw/zinc/16/08/02/1059160802.db2.gz HDDDYOOHGIJFES-KZULUSFZSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@@H]1C[C@H](c2ccccc2F)[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000743856135 1059160811 /nfs/dbraw/zinc/16/08/11/1059160811.db2.gz HDDDYOOHGIJFES-KZULUSFZSA-N 1 1 332.350 4.456 20 5 EIBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000743869609 1059185256 /nfs/dbraw/zinc/18/52/56/1059185256.db2.gz SKFQPYOPDHNFNX-JSGCOSHPSA-N 1 1 328.865 4.354 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@H]1c1ccccc1 ZINC001168958775 1060555767 /nfs/dbraw/zinc/55/57/67/1060555767.db2.gz ZUKHDSVKPIHSRL-SFHVURJKSA-N 1 1 326.396 4.331 20 5 EIBDMO CC[N@@H+](Cc1ccc(Cl)cc1Cl)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169044849 1060598746 /nfs/dbraw/zinc/59/87/46/1060598746.db2.gz JCJIIPKWIZCECD-FZMZJTMJSA-N 1 1 331.243 4.261 20 5 EIBDMO C[C@@]12c3ccccc3[C@@H](Cc3ccccc31)[N@@H+]2[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169047482 1060602872 /nfs/dbraw/zinc/60/28/72/1060602872.db2.gz RFGBGFIEVOMLJA-VIDZHXABSA-N 1 1 348.446 4.308 20 5 EIBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCCC3(CCCCC3)CC2)c1 ZINC001169306825 1060765191 /nfs/dbraw/zinc/76/51/91/1060765191.db2.gz JIXRKMYQYBDPBC-SFHVURJKSA-N 1 1 332.444 4.065 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[NH+]1CCC(Oc2ccccc2Cl)CC1 ZINC000532826157 1032335102 /nfs/dbraw/zinc/33/51/02/1032335102.db2.gz HHASTSZTTKMGAH-UHFFFAOYSA-N 1 1 346.814 4.292 20 5 EIBDMO C[C@@H]([N@@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C1(C)CC1 ZINC000091900264 1032857483 /nfs/dbraw/zinc/85/74/83/1032857483.db2.gz GPURONKJNLGFIY-GFCCVEGCSA-N 1 1 331.441 4.339 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+](Cc1cccc(O)c1)CC1CC1 ZINC000609705116 1020031424 /nfs/dbraw/zinc/03/14/24/1020031424.db2.gz QSUVKGUFRIQUAK-UHFFFAOYSA-N 1 1 346.814 4.366 20 5 EIBDMO 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1030932485 /nfs/dbraw/zinc/93/24/85/1030932485.db2.gz VABBIKXQTUYLQF-QGZVFWFLSA-N 1 1 345.487 4.071 20 5 EIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@H](C)CC(C)(C)C1 ZINC000612134821 1031029107 /nfs/dbraw/zinc/02/91/07/1031029107.db2.gz CWRGZEWZOJFCJU-CHWSQXEVSA-N 1 1 344.415 4.074 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3csc(C4CC4)n3)C2)cc1 ZINC000449502974 1031811354 /nfs/dbraw/zinc/81/13/54/1031811354.db2.gz SKIMFSUCZWQXCW-OAHLLOKOSA-N 1 1 343.452 4.308 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3csc(C4CC4)n3)C2)cc1 ZINC000449502974 1031811364 /nfs/dbraw/zinc/81/13/64/1031811364.db2.gz SKIMFSUCZWQXCW-OAHLLOKOSA-N 1 1 343.452 4.308 20 5 EIBDMO COC[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000449782375 1032005439 /nfs/dbraw/zinc/00/54/39/1032005439.db2.gz ZGRKSCQEMSIIIU-HNNXBMFYSA-N 1 1 344.411 4.103 20 5 EIBDMO Cc1c(C[N@H+](C)[C@H]2CC[C@@H](C(F)(F)F)CC2)cccc1[N+](=O)[O-] ZINC000573480226 1033365828 /nfs/dbraw/zinc/36/58/28/1033365828.db2.gz VMYSDHIBODMGAY-OKILXGFUSA-N 1 1 330.350 4.456 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@@H]3C3CCC3)cs2)c1 ZINC000512621668 1033517451 /nfs/dbraw/zinc/51/74/51/1033517451.db2.gz ARMIBGMYCDVKHX-QGZVFWFLSA-N 1 1 343.452 4.483 20 5 EIBDMO C[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)CC1CCCC1 ZINC000512669724 1033678243 /nfs/dbraw/zinc/67/82/43/1033678243.db2.gz XSFQNKGYVJTIQE-UHFFFAOYSA-N 1 1 331.441 4.340 20 5 EIBDMO C[C@H]1CC[C@@H]([N@@H+](C)Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000433040095 1033710512 /nfs/dbraw/zinc/71/05/12/1033710512.db2.gz QVRSSHPZEUMFAJ-SWLSCSKDSA-N 1 1 331.441 4.339 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H](c4ccccc4)C3)nc2c1 ZINC000433083670 1033817000 /nfs/dbraw/zinc/81/70/00/1033817000.db2.gz QGRMCBMPLSQCTJ-HNNXBMFYSA-N 1 1 337.379 4.116 20 5 EIBDMO COc1ccc(C)cc1[C@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595005073 1035527911 /nfs/dbraw/zinc/52/79/11/1035527911.db2.gz XAGUVZDNYJWTEV-KGLIPLIRSA-N 1 1 344.411 4.332 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccc(Cl)cc1F ZINC000595033887 1035561652 /nfs/dbraw/zinc/56/16/52/1035561652.db2.gz RUZITXPGSBLYJU-SNVBAGLBSA-N 1 1 338.766 4.247 20 5 EIBDMO C[C@H]([NH2+]Cc1cc(F)ccc1OC(F)F)c1cccc([N+](=O)[O-])c1 ZINC000595094251 1035606000 /nfs/dbraw/zinc/60/60/00/1035606000.db2.gz SXEFFGJZDGDPOZ-JTQLQIEISA-N 1 1 340.301 4.186 20 5 EIBDMO C[C@@H]([NH2+]Cc1cc(F)ccc1OC(F)F)c1cccc([N+](=O)[O-])c1 ZINC000595094252 1035606795 /nfs/dbraw/zinc/60/67/95/1035606795.db2.gz SXEFFGJZDGDPOZ-SNVBAGLBSA-N 1 1 340.301 4.186 20 5 EIBDMO Cc1noc(C[N@H+](Cc2ccccc2)C2CCCCC2)c1[N+](=O)[O-] ZINC000595295677 1035619009 /nfs/dbraw/zinc/61/90/09/1035619009.db2.gz OSTRIEDZWGVUPF-UHFFFAOYSA-N 1 1 329.400 4.226 20 5 EIBDMO Cc1noc(C[N@@H+](Cc2ccccc2)C2CCCCC2)c1[N+](=O)[O-] ZINC000595295677 1035619029 /nfs/dbraw/zinc/61/90/29/1035619029.db2.gz OSTRIEDZWGVUPF-UHFFFAOYSA-N 1 1 329.400 4.226 20 5 EIBDMO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1ccc(F)cc1[N+](=O)[O-])CCC2 ZINC000595375731 1035669229 /nfs/dbraw/zinc/66/92/29/1035669229.db2.gz VHFBPITUSCJMJG-AWEZNQCLSA-N 1 1 335.404 4.008 20 5 EIBDMO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-])CCC2 ZINC000595375731 1035669242 /nfs/dbraw/zinc/66/92/42/1035669242.db2.gz VHFBPITUSCJMJG-AWEZNQCLSA-N 1 1 335.404 4.008 20 5 EIBDMO C[C@H]([NH2+]Cc1cccc(F)c1OC(F)F)c1ccccc1[N+](=O)[O-] ZINC000595427039 1035676539 /nfs/dbraw/zinc/67/65/39/1035676539.db2.gz WGWINYFZCSWAHC-JTQLQIEISA-N 1 1 340.301 4.186 20 5 EIBDMO C[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@H]1CCCC[C@H]1C(F)(F)F ZINC000595493516 1035690060 /nfs/dbraw/zinc/69/00/60/1035690060.db2.gz LQPSWRFHMXEOLE-OLZOCXBDSA-N 1 1 334.313 4.287 20 5 EIBDMO C[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@H]1CCCC[C@H]1C(F)(F)F ZINC000595493516 1035690071 /nfs/dbraw/zinc/69/00/71/1035690071.db2.gz LQPSWRFHMXEOLE-OLZOCXBDSA-N 1 1 334.313 4.287 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]([C@@H]3CCCCO3)C2)c(Cl)c1 ZINC000595787992 1035792082 /nfs/dbraw/zinc/79/20/82/1035792082.db2.gz LQJIYPMQYUZWGM-PBHICJAKSA-N 1 1 338.835 4.029 20 5 EIBDMO C[C@@H]([NH2+][C@@H]1CCc2ccccc2-n2ccnc21)c1cccc([N+](=O)[O-])c1 ZINC000596093742 1035820572 /nfs/dbraw/zinc/82/05/72/1035820572.db2.gz FTGNZBSKUYCGIS-RDTXWAMCSA-N 1 1 348.406 4.119 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](CC(F)F)c1ccccc1 ZINC000420987777 1035898334 /nfs/dbraw/zinc/89/83/34/1035898334.db2.gz RDRMJFMZEFHQOZ-OAHLLOKOSA-N 1 1 336.338 4.090 20 5 EIBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCC1(F)F ZINC000588232575 1036307263 /nfs/dbraw/zinc/30/72/63/1036307263.db2.gz OLIGMEQGVKCERD-RISCZKNCSA-N 1 1 330.400 4.243 20 5 EIBDMO CO[C@]1(C)CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602639721 1036531433 /nfs/dbraw/zinc/53/14/33/1036531433.db2.gz YUWCSQMIGXRAHD-OAHLLOKOSA-N 1 1 346.349 4.005 20 5 EIBDMO Cc1ccc2c(c1)[C@H]([NH2+]Cc1nc3cc([N+](=O)[O-])ccc3o1)CCC2 ZINC000602671285 1036548598 /nfs/dbraw/zinc/54/85/98/1036548598.db2.gz FNNLZIURUXNNSL-MRXNPFEDSA-N 1 1 337.379 4.212 20 5 EIBDMO Cc1cccc(C2([NH2+]Cc3nc4cc([N+](=O)[O-])ccc4o3)CCC2)c1 ZINC000602701885 1036578607 /nfs/dbraw/zinc/57/86/07/1036578607.db2.gz YTVGJFHABQCUHD-UHFFFAOYSA-N 1 1 337.379 4.213 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](c2ccc3cccnc3n2)C1 ZINC000602888762 1036659322 /nfs/dbraw/zinc/65/93/22/1036659322.db2.gz RCUBUGXLDQZFBA-PBHICJAKSA-N 1 1 348.406 4.089 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cc4cnccc4o3)C2)cc1 ZINC000593632925 1036812310 /nfs/dbraw/zinc/81/23/10/1036812310.db2.gz XTDHPJXRNKFHLK-HNNXBMFYSA-N 1 1 337.379 4.116 20 5 EIBDMO CCCCC[C@H]1CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000486812300 1036861457 /nfs/dbraw/zinc/86/14/57/1036861457.db2.gz ZMHOOKXEILSRLI-HNNXBMFYSA-N 1 1 344.415 4.190 20 5 EIBDMO CC(C)c1ccc(C[N@H+]2CC3(CCOCC3)[C@@H]2C2CC2)cc1[N+](=O)[O-] ZINC000590380235 1037055412 /nfs/dbraw/zinc/05/54/12/1037055412.db2.gz WIDUAJVSIYPODQ-IBGZPJMESA-N 1 1 344.455 4.109 20 5 EIBDMO C[NH+](C)[C@H](CNc1ccc([N+](=O)[O-])s1)c1ccccc1Cl ZINC000603937402 1037099481 /nfs/dbraw/zinc/09/94/81/1037099481.db2.gz RHACAQTXYRIKJJ-GFCCVEGCSA-N 1 1 325.821 4.025 20 5 EIBDMO CC(C)c1ccc(CNCCC[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000604478803 1037396969 /nfs/dbraw/zinc/39/69/69/1037396969.db2.gz RKOVFCZSRSVLKV-MRXNPFEDSA-N 1 1 333.476 4.072 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cc3ccc(F)cc3[nH]2)C2CC2)cc1 ZINC000488348092 1037536379 /nfs/dbraw/zinc/53/63/79/1037536379.db2.gz BREGHSPGPOQXPI-UHFFFAOYSA-N 1 1 339.370 4.380 20 5 EIBDMO CC[C@H]([NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-])c1ccccc1F ZINC000593060810 1037898086 /nfs/dbraw/zinc/89/80/86/1037898086.db2.gz JLDYSBGEHBUCGE-HNNXBMFYSA-N 1 1 336.338 4.123 20 5 EIBDMO COc1cc(C[N@H+](Cc2ccccc2F)C(C)C)ccc1[N+](=O)[O-] ZINC000489252493 1037917505 /nfs/dbraw/zinc/91/75/05/1037917505.db2.gz DXKAIJRJFYRZCK-UHFFFAOYSA-N 1 1 332.375 4.153 20 5 EIBDMO COc1cc(C[N@@H+](Cc2ccccc2F)C(C)C)ccc1[N+](=O)[O-] ZINC000489252493 1037917530 /nfs/dbraw/zinc/91/75/30/1037917530.db2.gz DXKAIJRJFYRZCK-UHFFFAOYSA-N 1 1 332.375 4.153 20 5 EIBDMO CC(C)c1ccc([C@H](N)C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000423243134 1038078188 /nfs/dbraw/zinc/07/81/88/1038078188.db2.gz MTRKAWPNUDPSRU-AUUYWEPGSA-N 1 1 327.428 4.069 20 5 EIBDMO COc1cc(C[N@@H+]2CC[C@H](C)C[C@@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000490067087 1038332629 /nfs/dbraw/zinc/33/26/29/1038332629.db2.gz LUALNFKOGBVNPF-XJKSGUPXSA-N 1 1 330.384 4.170 20 5 EIBDMO COc1cc(C[N@H+]2CC[C@H](C)C[C@@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000490067087 1038332649 /nfs/dbraw/zinc/33/26/49/1038332649.db2.gz LUALNFKOGBVNPF-XJKSGUPXSA-N 1 1 330.384 4.170 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](CSc3ccccc3)C2)c(F)c1 ZINC000490377712 1038610430 /nfs/dbraw/zinc/61/04/30/1038610430.db2.gz XLGXYNKKJLGLOC-AWEZNQCLSA-N 1 1 346.427 4.348 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2cccc(OC(C)(C)C)n2)cc1[N+](=O)[O-] ZINC000539061916 1038805834 /nfs/dbraw/zinc/80/58/34/1038805834.db2.gz QIFGWRCYRBIWRC-CQSZACIVSA-N 1 1 343.427 4.326 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@H]2c2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000514244152 1039806260 /nfs/dbraw/zinc/80/62/60/1039806260.db2.gz CXWWEKMDKLFIKQ-KRWDZBQOSA-N 1 1 326.396 4.249 20 5 EIBDMO COc1cccc(F)c1[C@@H](C)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192904834 1039850868 /nfs/dbraw/zinc/85/08/68/1039850868.db2.gz SSZUYSZYVGJURR-SJKOYZFVSA-N 1 1 344.386 4.471 20 5 EIBDMO CC[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C1CCCC1 ZINC000159417522 1039995278 /nfs/dbraw/zinc/99/52/78/1039995278.db2.gz MYPSURBFJLTAOI-UHFFFAOYSA-N 1 1 327.222 4.122 20 5 EIBDMO COc1cccc([C@@H]2CCC[N@@H+]2Cc2c(F)cccc2[N+](=O)[O-])c1 ZINC000505608025 1040071972 /nfs/dbraw/zinc/07/19/72/1040071972.db2.gz GWQDYFCGSNCGTJ-KRWDZBQOSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1cccc([C@@H]2CCC[N@H+]2Cc2c(F)cccc2[N+](=O)[O-])c1 ZINC000505608025 1040071988 /nfs/dbraw/zinc/07/19/88/1040071988.db2.gz GWQDYFCGSNCGTJ-KRWDZBQOSA-N 1 1 330.359 4.080 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC=C(c4ccccc4)C3)nc2c1 ZINC000551405576 1040266613 /nfs/dbraw/zinc/26/66/13/1040266613.db2.gz UIDBMRHFFHEWOA-UHFFFAOYSA-N 1 1 335.363 4.025 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC=C(c4ccccc4)C3)nc2c1 ZINC000551405576 1040266629 /nfs/dbraw/zinc/26/66/29/1040266629.db2.gz UIDBMRHFFHEWOA-UHFFFAOYSA-N 1 1 335.363 4.025 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H](c3nc4ccccc4o3)C2)c1 ZINC000029824792 1040281406 /nfs/dbraw/zinc/28/14/06/1040281406.db2.gz JHNTYJJVLQSOBG-OAHLLOKOSA-N 1 1 337.379 4.116 20 5 EIBDMO CC(=O)c1cc(NC[C@@H]2CCC[N@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000553556771 1040297319 /nfs/dbraw/zinc/29/73/19/1040297319.db2.gz OHSBBMFXNMMQIF-KRWDZBQOSA-N 1 1 345.443 4.006 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000539807238 1040803053 /nfs/dbraw/zinc/80/30/53/1040803053.db2.gz ZGTDWBAKZDITBS-GXTWGEPZSA-N 1 1 346.349 4.008 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000539807238 1040803057 /nfs/dbraw/zinc/80/30/57/1040803057.db2.gz ZGTDWBAKZDITBS-GXTWGEPZSA-N 1 1 346.349 4.008 20 5 EIBDMO CCCCO[C@@H]1C[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)C1(C)C ZINC001167960098 1040803870 /nfs/dbraw/zinc/80/38/70/1040803870.db2.gz SCCZYVQSLMTJLU-DLBZAZTESA-N 1 1 338.423 4.150 20 5 EIBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000515539442 1040840327 /nfs/dbraw/zinc/84/03/27/1040840327.db2.gz PEMFRHBZABHAOW-LJQANCHMSA-N 1 1 326.396 4.249 20 5 EIBDMO COCCCCc1ccc[nH+]c1NC/C=C\c1ccccc1[N+](=O)[O-] ZINC000462826806 1040978075 /nfs/dbraw/zinc/97/80/75/1040978075.db2.gz DVXHLAWJPFWNHU-POHAHGRESA-N 1 1 341.411 4.084 20 5 EIBDMO CC[C@H]1CC[C@@H](C)[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000540055680 1041076065 /nfs/dbraw/zinc/07/60/65/1041076065.db2.gz KARZZHQZLLMPKP-HIFRSBDPSA-N 1 1 329.400 4.055 20 5 EIBDMO COc1ccc(C[N@@H+](C)[C@H]2CCCC[C@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000463045895 1041274705 /nfs/dbraw/zinc/27/47/05/1041274705.db2.gz YMMBKAUVFMZFCG-OLZOCXBDSA-N 1 1 346.349 4.156 20 5 EIBDMO Cc1c(C[NH2+]Cc2csc(-c3ccccc3)n2)cccc1[N+](=O)[O-] ZINC000480474019 1041326597 /nfs/dbraw/zinc/32/65/97/1041326597.db2.gz KZWMYIPMJINRNU-UHFFFAOYSA-N 1 1 339.420 4.317 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+]C1(c2ccccc2)CC1 ZINC000540359127 1041412563 /nfs/dbraw/zinc/41/25/63/1041412563.db2.gz KSOKDGCDFICORF-UHFFFAOYSA-N 1 1 326.396 4.161 20 5 EIBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1csc(C(C)(C)C)n1 ZINC000554847052 1041454406 /nfs/dbraw/zinc/45/44/06/1041454406.db2.gz PLNKQQLHGKSXAR-UHFFFAOYSA-N 1 1 333.457 4.023 20 5 EIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1csc(C(C)(C)C)n1 ZINC000554847052 1041454408 /nfs/dbraw/zinc/45/44/08/1041454408.db2.gz PLNKQQLHGKSXAR-UHFFFAOYSA-N 1 1 333.457 4.023 20 5 EIBDMO C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000538726801 1041498303 /nfs/dbraw/zinc/49/83/03/1041498303.db2.gz YJQCWHAHASNPTR-LSDHHAIUSA-N 1 1 342.443 4.006 20 5 EIBDMO CC[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])[C@@H]1CCOC(C)(C)C1 ZINC000516352181 1041541141 /nfs/dbraw/zinc/54/11/41/1041541141.db2.gz QCVDWSYIXWFTJK-GFCCVEGCSA-N 1 1 326.824 4.028 20 5 EIBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463451746 1041572744 /nfs/dbraw/zinc/57/27/44/1041572744.db2.gz OHEMVRDVGQVRER-OLZOCXBDSA-N 1 1 346.349 4.027 20 5 EIBDMO COc1cc(C[N@H+](C)[C@H](C)c2ccccc2C)c([N+](=O)[O-])cc1F ZINC000463502713 1041595141 /nfs/dbraw/zinc/59/51/41/1041595141.db2.gz QKGLLXNFHWUVBF-CYBMUJFWSA-N 1 1 332.375 4.244 20 5 EIBDMO COc1cc(C[N@@H+](C)[C@H](C)c2ccccc2C)c([N+](=O)[O-])cc1F ZINC000463502713 1041595145 /nfs/dbraw/zinc/59/51/45/1041595145.db2.gz QKGLLXNFHWUVBF-CYBMUJFWSA-N 1 1 332.375 4.244 20 5 EIBDMO COc1cc(C[N@H+]2CC[C@@H](c3ccccc3C)C2)c([N+](=O)[O-])cc1F ZINC000464097236 1041861381 /nfs/dbraw/zinc/86/13/81/1041861381.db2.gz FNGDJRPMUQGNFT-CQSZACIVSA-N 1 1 344.386 4.040 20 5 EIBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(Nc2ncc([N+](=O)[O-])s2)cc1 ZINC000443512439 1041869579 /nfs/dbraw/zinc/86/95/79/1041869579.db2.gz UFZQIDOABQBRQO-GFCCVEGCSA-N 1 1 332.429 4.169 20 5 EIBDMO COc1cccc([C@@H]2C[C@@H](C)C[N@@H+]2Cc2csc([N+](=O)[O-])c2)c1 ZINC000541320200 1041892325 /nfs/dbraw/zinc/89/23/25/1041892325.db2.gz HEXHKLCFDIMTEP-WBMJQRKESA-N 1 1 332.425 4.248 20 5 EIBDMO COc1cccc([C@@H]2C[C@@H](C)C[N@H+]2Cc2csc([N+](=O)[O-])c2)c1 ZINC000541320200 1041892327 /nfs/dbraw/zinc/89/23/27/1041892327.db2.gz HEXHKLCFDIMTEP-WBMJQRKESA-N 1 1 332.425 4.248 20 5 EIBDMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000464731339 1042135427 /nfs/dbraw/zinc/13/54/27/1042135427.db2.gz FDWZAXAMDAQFBP-XJKSGUPXSA-N 1 1 344.415 4.045 20 5 EIBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@H](CSc3ccccc3)C2)cc1 ZINC000464776693 1042159038 /nfs/dbraw/zinc/15/90/38/1042159038.db2.gz SGWBXOYSZQJFLL-QGZVFWFLSA-N 1 1 342.464 4.252 20 5 EIBDMO COc1ccc(C[N@@H+]2CC[C@@H](C)C[C@@H]2c2ccc(C)o2)cc1[N+](=O)[O-] ZINC000464828897 1042186381 /nfs/dbraw/zinc/18/63/81/1042186381.db2.gz DTKVBISCNPKZIV-CZUORRHYSA-N 1 1 344.411 4.478 20 5 EIBDMO COc1ccc(C[N@H+]2CC[C@@H](C)C[C@@H]2c2ccc(C)o2)cc1[N+](=O)[O-] ZINC000464828897 1042186383 /nfs/dbraw/zinc/18/63/83/1042186383.db2.gz DTKVBISCNPKZIV-CZUORRHYSA-N 1 1 344.411 4.478 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(CCc3ccc(O)cc3)CC2)cs1 ZINC000517831264 1042213562 /nfs/dbraw/zinc/21/35/62/1042213562.db2.gz DZBIEKDWJYCSOM-UHFFFAOYSA-N 1 1 346.452 4.207 20 5 EIBDMO C[C@@H]1C[C@H]1c1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)o1 ZINC000030150810 1042492153 /nfs/dbraw/zinc/49/21/53/1042492153.db2.gz CKTASMDEKYBDTB-FZKQIMNGSA-N 1 1 326.396 4.476 20 5 EIBDMO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)o1 ZINC000030150810 1042492156 /nfs/dbraw/zinc/49/21/56/1042492156.db2.gz CKTASMDEKYBDTB-FZKQIMNGSA-N 1 1 326.396 4.476 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2ccccc2C)C2CC2)cc1[N+](=O)[O-] ZINC000506548393 1042588793 /nfs/dbraw/zinc/58/87/93/1042588793.db2.gz VKCGRCLNYJOHGV-UHFFFAOYSA-N 1 1 326.396 4.076 20 5 EIBDMO CCOc1ccccc1C[N@H+](C)Cc1ccc([N+](=O)[O-])c(OCC)c1 ZINC000492375742 1042623866 /nfs/dbraw/zinc/62/38/66/1042623866.db2.gz KOFDWLRRORSOOV-UHFFFAOYSA-N 1 1 344.411 4.024 20 5 EIBDMO CCOc1ccccc1C[N@@H+](C)Cc1ccc([N+](=O)[O-])c(OCC)c1 ZINC000492375742 1042623872 /nfs/dbraw/zinc/62/38/72/1042623872.db2.gz KOFDWLRRORSOOV-UHFFFAOYSA-N 1 1 344.411 4.024 20 5 EIBDMO CC(C)([NH2+]Cc1cnc(C2CCC2)s1)c1ccccc1[N+](=O)[O-] ZINC000492399689 1042633899 /nfs/dbraw/zinc/63/38/99/1042633899.db2.gz QDHUFXXWDUSDBL-UHFFFAOYSA-N 1 1 331.441 4.344 20 5 EIBDMO COc1ccc(C[N@@H+]([C@H](C)c2ccccc2)C2CC2)cc1[N+](=O)[O-] ZINC000506591940 1042651627 /nfs/dbraw/zinc/65/16/27/1042651627.db2.gz DOARZZYQQWKWBK-CQSZACIVSA-N 1 1 326.396 4.329 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCCC[C@@H]3c3ccccc3)nc2c1 ZINC000439484265 1042660012 /nfs/dbraw/zinc/66/00/12/1042660012.db2.gz DVFKGVHLCGMLFY-GOSISDBHSA-N 1 1 336.395 4.198 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCCC[C@@H]3c3ccccc3)nc2c1 ZINC000439484265 1042660026 /nfs/dbraw/zinc/66/00/26/1042660026.db2.gz DVFKGVHLCGMLFY-GOSISDBHSA-N 1 1 336.395 4.198 20 5 EIBDMO CCOc1cc(C[N@@H+](C)[C@@H]2CCc3ccccc32)ccc1[N+](=O)[O-] ZINC000492460714 1042664582 /nfs/dbraw/zinc/66/45/82/1042664582.db2.gz IWANTWILZUJNNW-QGZVFWFLSA-N 1 1 326.396 4.113 20 5 EIBDMO COc1cc(C[N@H+](C)Cc2ccc(Cl)c(F)c2)ccc1[N+](=O)[O-] ZINC000492683369 1042722071 /nfs/dbraw/zinc/72/20/71/1042722071.db2.gz NDQZNHFZKLBFMR-UHFFFAOYSA-N 1 1 338.766 4.028 20 5 EIBDMO COc1cc(C[N@@H+](C)Cc2ccc(Cl)c(F)c2)ccc1[N+](=O)[O-] ZINC000492683369 1042722078 /nfs/dbraw/zinc/72/20/78/1042722078.db2.gz NDQZNHFZKLBFMR-UHFFFAOYSA-N 1 1 338.766 4.028 20 5 EIBDMO CCOc1cc(C[N@@H+](C)[C@H]2CC[C@@H](SCC)C2)ccc1[N+](=O)[O-] ZINC000492776076 1042746855 /nfs/dbraw/zinc/74/68/55/1042746855.db2.gz TZRWPXUVUQTXML-LSDHHAIUSA-N 1 1 338.473 4.100 20 5 EIBDMO COc1cc(C[NH2+]C2(c3ccc(F)cc3F)CCC2)ccc1[N+](=O)[O-] ZINC000492759058 1042747217 /nfs/dbraw/zinc/74/72/17/1042747217.db2.gz WCQNBEGDZDTQME-UHFFFAOYSA-N 1 1 348.349 4.051 20 5 EIBDMO CCS[C@@H]1CC[C@H]([N@H+](C)Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493136842 1042827851 /nfs/dbraw/zinc/82/78/51/1042827851.db2.gz ZYMLCOXQPBWZCP-NWDGAFQWSA-N 1 1 328.865 4.354 20 5 EIBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493136842 1042827853 /nfs/dbraw/zinc/82/78/53/1042827853.db2.gz ZYMLCOXQPBWZCP-NWDGAFQWSA-N 1 1 328.865 4.354 20 5 EIBDMO CC[N@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)C[C@@H](O)c1ccc(C)cc1 ZINC000761512776 1042873578 /nfs/dbraw/zinc/87/35/78/1042873578.db2.gz WTEAOKUQKXFRRZ-GOSISDBHSA-N 1 1 348.830 4.112 20 5 EIBDMO C[N@H+](Cc1cccc2[nH]ccc21)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000494039327 1043011577 /nfs/dbraw/zinc/01/15/77/1043011577.db2.gz SNTQTGFOVPIXTD-UHFFFAOYSA-N 1 1 329.787 4.362 20 5 EIBDMO C[N@@H+](Cc1cccc2[nH]ccc21)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000494039327 1043011583 /nfs/dbraw/zinc/01/15/83/1043011583.db2.gz SNTQTGFOVPIXTD-UHFFFAOYSA-N 1 1 329.787 4.362 20 5 EIBDMO COc1cc(C[N@@H+]2CCC[C@H]2c2cccs2)c([N+](=O)[O-])cc1OC ZINC000162697786 1043152314 /nfs/dbraw/zinc/15/23/14/1043152314.db2.gz VPMDOAFMXBWPKS-ZDUSSCGKSA-N 1 1 348.424 4.011 20 5 EIBDMO COc1cc(C[N@H+]2CCC[C@H]2c2cccs2)c([N+](=O)[O-])cc1OC ZINC000162697786 1043152321 /nfs/dbraw/zinc/15/23/21/1043152321.db2.gz VPMDOAFMXBWPKS-ZDUSSCGKSA-N 1 1 348.424 4.011 20 5 EIBDMO CO[C@@]1(C)CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602639719 1043154836 /nfs/dbraw/zinc/15/48/36/1043154836.db2.gz YUWCSQMIGXRAHD-HNNXBMFYSA-N 1 1 346.349 4.005 20 5 EIBDMO C[C@H](CCO)[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542976471 1043210102 /nfs/dbraw/zinc/21/01/02/1043210102.db2.gz YUNJNDDWFHFVRR-CQSZACIVSA-N 1 1 348.830 4.021 20 5 EIBDMO C[C@H](CCO)[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542976471 1043210110 /nfs/dbraw/zinc/21/01/10/1043210110.db2.gz YUNJNDDWFHFVRR-CQSZACIVSA-N 1 1 348.830 4.021 20 5 EIBDMO Cc1c(C[N@@H+]2CCCC[C@@H]2[C@@H]2C[C@H](C)CC[C@@H]2O)cccc1[N+](=O)[O-] ZINC000438993667 1043742007 /nfs/dbraw/zinc/74/20/07/1043742007.db2.gz ACUJEQHOLGEVQH-FPWFTKFVSA-N 1 1 346.471 4.055 20 5 EIBDMO Cc1c(C[N@H+]2CCC[C@@H]2Cc2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000521424606 1043763006 /nfs/dbraw/zinc/76/30/06/1043763006.db2.gz OFAMYUXZNCCSSF-GOSISDBHSA-N 1 1 328.387 4.249 20 5 EIBDMO COc1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000078968918 1043818709 /nfs/dbraw/zinc/81/87/09/1043818709.db2.gz LAKIECURDQTVIV-OLZOCXBDSA-N 1 1 330.384 4.024 20 5 EIBDMO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccc(Br)s1 ZINC000443002221 1043952709 /nfs/dbraw/zinc/95/27/09/1043952709.db2.gz OTRYZVFSELDDST-SSDOTTSWSA-N 1 1 347.259 4.331 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)cc1 ZINC000115612820 1043965594 /nfs/dbraw/zinc/96/55/94/1043965594.db2.gz PZUOISOZDYFPCJ-UHFFFAOYSA-N 1 1 344.317 4.423 20 5 EIBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)cc1 ZINC000732989097 1044062366 /nfs/dbraw/zinc/06/23/66/1044062366.db2.gz ODGIDJHNYOSFBU-GOSISDBHSA-N 1 1 348.349 4.089 20 5 EIBDMO CC(C)c1ccc(C[NH2+][C@@H]2COc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000466472154 1044575289 /nfs/dbraw/zinc/57/52/89/1044575289.db2.gz GEMRHHOFUNXDSS-MRXNPFEDSA-N 1 1 330.359 4.081 20 5 EIBDMO Cc1cc(C)c([C@@H](C)[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)c(C)c1 ZINC000543477051 1044682012 /nfs/dbraw/zinc/68/20/12/1044682012.db2.gz ZTKOGIPBSDNLDX-OAHLLOKOSA-N 1 1 325.412 4.034 20 5 EIBDMO Cc1cc(C)c([C@@H](C)[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)c(C)c1 ZINC000543477051 1044682015 /nfs/dbraw/zinc/68/20/15/1044682015.db2.gz ZTKOGIPBSDNLDX-OAHLLOKOSA-N 1 1 325.412 4.034 20 5 EIBDMO Cc1cccc(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)[nH+]1 ZINC000131171152 1044727099 /nfs/dbraw/zinc/72/70/99/1044727099.db2.gz NRKIMXYDOCZRLS-UHFFFAOYSA-N 1 1 326.381 4.034 20 5 EIBDMO COC[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000093337467 1044831925 /nfs/dbraw/zinc/83/19/25/1044831925.db2.gz BXYJKGNHKYEUMC-AWEZNQCLSA-N 1 1 346.452 4.182 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(N[C@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C)c1 ZINC000716233012 1044857132 /nfs/dbraw/zinc/85/71/32/1044857132.db2.gz TYZRNLKQBIXQFC-LPHOPBHVSA-N 1 1 339.439 4.226 20 5 EIBDMO C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000736627157 1044959849 /nfs/dbraw/zinc/95/98/49/1044959849.db2.gz CLFIXOWMOIREBE-TZMCWYRMSA-N 1 1 332.350 4.251 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](c1ccc(C)o1)C1CCC1 ZINC000544573176 1044966239 /nfs/dbraw/zinc/96/62/39/1044966239.db2.gz OKQMXJKJXLAZBU-SFHVURJKSA-N 1 1 330.384 4.136 20 5 EIBDMO CCC[C@H](NC1CC(C)(C)[NH2+]C(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000391887602 1044996094 /nfs/dbraw/zinc/99/60/94/1044996094.db2.gz XKMOKGRSHCWCBL-KRWDZBQOSA-N 1 1 333.476 4.335 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](Cc1cccnc1)C(C)C ZINC000125702277 1045038549 /nfs/dbraw/zinc/03/85/49/1045038549.db2.gz QNDVCGUIJMWBCK-UHFFFAOYSA-N 1 1 343.427 4.188 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](Cc1cccnc1)C(C)C ZINC000125702277 1045038562 /nfs/dbraw/zinc/03/85/62/1045038562.db2.gz QNDVCGUIJMWBCK-UHFFFAOYSA-N 1 1 343.427 4.188 20 5 EIBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CC[C@H](c3ccc(F)cc3)C2)c(F)c1 ZINC000509391219 1045080880 /nfs/dbraw/zinc/08/08/80/1045080880.db2.gz XVYZCYDNCZKLEZ-LBPRGKRZSA-N 1 1 336.313 4.002 20 5 EIBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CC[C@H](c3ccc(F)cc3)C2)c(F)c1 ZINC000509391219 1045080896 /nfs/dbraw/zinc/08/08/96/1045080896.db2.gz XVYZCYDNCZKLEZ-LBPRGKRZSA-N 1 1 336.313 4.002 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccc(OC(F)F)cc1)C1CC1 ZINC000215664123 1045213454 /nfs/dbraw/zinc/21/34/54/1045213454.db2.gz YBSABDRVRXXENZ-UHFFFAOYSA-N 1 1 348.349 4.361 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccc(OC(F)F)cc1)C1CC1 ZINC000215664123 1045213465 /nfs/dbraw/zinc/21/34/65/1045213465.db2.gz YBSABDRVRXXENZ-UHFFFAOYSA-N 1 1 348.349 4.361 20 5 EIBDMO CC(C)[N@@H+](C)Cc1ccccc1CNc1ccc([N+](=O)[O-])cc1F ZINC000301064147 1045228733 /nfs/dbraw/zinc/22/87/33/1045228733.db2.gz BZLOUWJWVUHXDJ-UHFFFAOYSA-N 1 1 331.391 4.186 20 5 EIBDMO CC[N@H+](Cc1ccoc1)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000611267948 1045271041 /nfs/dbraw/zinc/27/10/41/1045271041.db2.gz QPBJFXQDLSPFSG-UHFFFAOYSA-N 1 1 326.352 4.470 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+][C@@H]2COc3c2cccc3Cl)cc1[N+](=O)[O-] ZINC000611336165 1045281892 /nfs/dbraw/zinc/28/18/92/1045281892.db2.gz XHZFVDYQQVMOJU-XHDPSFHLSA-N 1 1 332.787 4.341 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cncc3ccccc32)C2CC2)cc1 ZINC000768336741 1045793189 /nfs/dbraw/zinc/79/31/89/1045793189.db2.gz LLXVEUHEOWSOCQ-UHFFFAOYSA-N 1 1 333.391 4.308 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)ccc1Cl ZINC000768542151 1045817653 /nfs/dbraw/zinc/81/76/53/1045817653.db2.gz NRRWZYQLFPMQFI-INIZCTEOSA-N 1 1 332.787 4.291 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)ccc1Cl ZINC000768542151 1045817655 /nfs/dbraw/zinc/81/76/55/1045817655.db2.gz NRRWZYQLFPMQFI-INIZCTEOSA-N 1 1 332.787 4.291 20 5 EIBDMO CC[N@@H+](CCc1ccccn1)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000769032127 1045871536 /nfs/dbraw/zinc/87/15/36/1045871536.db2.gz BALFLGMWSQKLFP-UHFFFAOYSA-N 1 1 327.428 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337.470 4.042 20 5 EIBDMO COc1ccc(C[N@H+]2C[C@@H](c3ccc(F)cc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000609916145 1049394256 /nfs/dbraw/zinc/39/42/56/1049394256.db2.gz AHUVLXNLCDYKHP-CJNGLKHVSA-N 1 1 344.386 4.121 20 5 EIBDMO COc1cc(C)ccc1[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000773040691 1049548009 /nfs/dbraw/zinc/54/80/09/1049548009.db2.gz LLQQUTWWZLGEDI-LBPRGKRZSA-N 1 1 334.803 4.416 20 5 EIBDMO CC[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812851314 1049613891 /nfs/dbraw/zinc/61/38/91/1049613891.db2.gz YCJOVMXPRVUHDU-SCLBCKFNSA-N 1 1 348.830 4.192 20 5 EIBDMO CCOc1ccccc1[C@H](CC)[NH2+]Cc1cc(F)ccc1[N+](=O)[O-] ZINC000179738441 1049743059 /nfs/dbraw/zinc/74/30/59/1049743059.db2.gz JTNRPMIVZQHLRB-INIZCTEOSA-N 1 1 332.375 4.374 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCc2ccc(F)cc2[C@@H](C)C1 ZINC001171670385 1049774218 /nfs/dbraw/zinc/77/42/18/1049774218.db2.gz DNZMJQAFRRKAJV-UONOGXRCSA-N 1 1 328.387 4.457 20 5 EIBDMO 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EIBDMO O=[N+]([O-])c1ccccc1S[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001186757350 1050406141 /nfs/dbraw/zinc/40/61/41/1050406141.db2.gz SLRWMYYSJSESRV-INIZCTEOSA-N 1 1 328.437 4.352 20 5 EIBDMO CC(C)[C@@H]1CN(c2sccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC001187044796 1050466286 /nfs/dbraw/zinc/46/62/86/1050466286.db2.gz PHPVATIABVDNEQ-KRWDZBQOSA-N 1 1 345.468 4.003 20 5 EIBDMO COc1cc(C)ccc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC001180178709 1050893862 /nfs/dbraw/zinc/89/38/62/1050893862.db2.gz ZXVURDGJWKFFFY-UHFFFAOYSA-N 1 1 328.412 4.322 20 5 EIBDMO C[C@@H]([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccsc1 ZINC000619782592 1050899912 /nfs/dbraw/zinc/89/99/12/1050899912.db2.gz FJTUZWVDKJWPDW-LLVKDONJSA-N 1 1 329.381 4.162 20 5 EIBDMO Cc1ccccc1[C@@H]1CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001190407493 1051176278 /nfs/dbraw/zinc/17/62/78/1051176278.db2.gz OSLJRJKNLRCUFA-IBGZPJMESA-N 1 1 326.396 4.119 20 5 EIBDMO CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H](C)c1ccc(F)cc1 ZINC001190474047 1051194421 /nfs/dbraw/zinc/19/44/21/1051194421.db2.gz CGBUXAAIKXYEFI-CQSZACIVSA-N 1 1 332.375 4.196 20 5 EIBDMO CC[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@H](C)Cc1ccc(OC)cc1 ZINC001190985116 1051316630 /nfs/dbraw/zinc/31/66/30/1051316630.db2.gz MYNCXALBIDORAQ-CQSZACIVSA-N 1 1 346.402 4.196 20 5 EIBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)Cc1ccncc1 ZINC000183738038 1051324862 /nfs/dbraw/zinc/32/48/62/1051324862.db2.gz GPMQDUOQWCJQTL-UHFFFAOYSA-N 1 1 339.420 4.350 20 5 EIBDMO C[C@@H](c1cccnc1)[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000183727229 1051328007 /nfs/dbraw/zinc/32/80/07/1051328007.db2.gz IXXQXIOSAVZAAL-AWEZNQCLSA-N 1 1 337.379 4.443 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CCc2cc(C(F)(F)F)ccc2C1 ZINC001175129950 1051396845 /nfs/dbraw/zinc/39/68/45/1051396845.db2.gz YRMZPLSVIPMNHV-UHFFFAOYSA-N 1 1 336.313 4.172 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCc2cc(C(F)(F)F)ccc2C1 ZINC001175129950 1051396855 /nfs/dbraw/zinc/39/68/55/1051396855.db2.gz YRMZPLSVIPMNHV-UHFFFAOYSA-N 1 1 336.313 4.172 20 5 EIBDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)C1(CC)CC ZINC001191822686 1051563145 /nfs/dbraw/zinc/56/31/45/1051563145.db2.gz YAYIOGAYBOULTI-SJORKVTESA-N 1 1 338.423 4.150 20 5 EIBDMO COc1ccccc1[C@@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC001175622994 1051678307 /nfs/dbraw/zinc/67/83/07/1051678307.db2.gz VZHBBNUVGCQNHW-OAHLLOKOSA-N 1 1 346.452 4.435 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCCSC[C@H]1c1ccccc1 ZINC001175769149 1051774342 /nfs/dbraw/zinc/77/43/42/1051774342.db2.gz PWIRHMONZFACAI-SFHVURJKSA-N 1 1 328.437 4.275 20 5 EIBDMO CC[C@@H]1Cc2ccccc2C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC001193117735 1051872708 /nfs/dbraw/zinc/87/27/08/1051872708.db2.gz PJKFXLVNZYYLPE-GOSISDBHSA-N 1 1 340.423 4.201 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC001184264504 1051980166 /nfs/dbraw/zinc/98/01/66/1051980166.db2.gz DPKHMSBLYXLXBW-IDJPSDCMSA-N 1 1 343.452 4.019 20 5 EIBDMO Cc1ccc([C@H]2C[C@@H](C)[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)cc1 ZINC001193932527 1052023531 /nfs/dbraw/zinc/02/35/31/1052023531.db2.gz PSXUOMQHMSMSTI-PBHICJAKSA-N 1 1 328.387 4.420 20 5 EIBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@H]2/C=C/c2ccccc2)cc1 ZINC001176641217 1052149515 /nfs/dbraw/zinc/14/95/15/1052149515.db2.gz QQRFPNBFCQOHIR-BLGFXRMMSA-N 1 1 338.407 4.151 20 5 EIBDMO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000774824445 1052172236 /nfs/dbraw/zinc/17/22/36/1052172236.db2.gz NJGMJNCHBGBWRO-GFCCVEGCSA-N 1 1 334.803 4.416 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@](C)(C(=O)OC(C)(C)C)C1 ZINC001194905788 1053160589 /nfs/dbraw/zinc/16/05/89/1053160589.db2.gz LMFZVMJKNUAVPP-IFXJQAMLSA-N 1 1 348.443 4.018 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000864037893 1053177332 /nfs/dbraw/zinc/17/73/32/1053177332.db2.gz CHFWETIFAXHURN-QGZVFWFLSA-N 1 1 345.830 4.325 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000864037893 1053177349 /nfs/dbraw/zinc/17/73/49/1053177349.db2.gz CHFWETIFAXHURN-QGZVFWFLSA-N 1 1 345.830 4.325 20 5 EIBDMO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)CCC2 ZINC000764937638 1053387391 /nfs/dbraw/zinc/38/73/91/1053387391.db2.gz DNPJQBCNCOLZQR-GUYCJALGSA-N 1 1 328.416 4.100 20 5 EIBDMO C[C@@]1(Cc2cccc(F)c2)CCC[N@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001195393191 1053396227 /nfs/dbraw/zinc/39/62/27/1053396227.db2.gz AEQYSJWCFNHUBI-IBGZPJMESA-N 1 1 346.377 4.470 20 5 EIBDMO COc1ccc(C[C@H]2CCCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)cc1 ZINC001195874271 1053512034 /nfs/dbraw/zinc/51/20/34/1053512034.db2.gz RPFWQULICOXIJJ-GOSISDBHSA-N 1 1 340.423 4.201 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@H](c2ccccn2)C1 ZINC000852087649 1053548750 /nfs/dbraw/zinc/54/87/50/1053548750.db2.gz OXBJRJJAEVSOKF-ZDUSSCGKSA-N 1 1 331.803 4.023 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@H](c2ccccn2)C1 ZINC000852087649 1053548762 /nfs/dbraw/zinc/54/87/62/1053548762.db2.gz OXBJRJJAEVSOKF-ZDUSSCGKSA-N 1 1 331.803 4.023 20 5 EIBDMO Cc1ccc([C@@H]2C[C@H](C)CC[N@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000776589569 1053574569 /nfs/dbraw/zinc/57/45/69/1053574569.db2.gz TVGRDIUJXZRUHC-JEBQAFNWSA-N 1 1 344.411 4.003 20 5 EIBDMO CCOc1cc(C[N@@H+](C)Cc2ccc3cc[nH]c3c2)ccc1[N+](=O)[O-] ZINC001197202539 1053852455 /nfs/dbraw/zinc/85/24/55/1053852455.db2.gz OERGBKIOJZHSNZ-UHFFFAOYSA-N 1 1 339.395 4.107 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)cc1[N+](=O)[O-] ZINC001168553461 1053889069 /nfs/dbraw/zinc/88/90/69/1053889069.db2.gz RGXJEXGYXSSGSC-NSHDSACASA-N 1 1 349.774 4.316 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H]1CCCc2cn(C(C)C)nc21 ZINC000873101705 1054486013 /nfs/dbraw/zinc/48/60/13/1054486013.db2.gz HUCPBZDPDWDLLQ-KRWDZBQOSA-N 1 1 342.443 4.156 20 5 EIBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1Nc1cccc(F)c1[N+](=O)[O-] ZINC000301588418 1055742659 /nfs/dbraw/zinc/74/26/59/1055742659.db2.gz PUUBGFJKUXNFAZ-WMLDXEAASA-N 1 1 343.402 4.056 20 5 EIBDMO CC[C@H](c1ccccc1OC)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC ZINC000554306311 1056055183 /nfs/dbraw/zinc/05/51/83/1056055183.db2.gz VZXBSVYXSFKRTD-QGZVFWFLSA-N 1 1 344.411 4.195 20 5 EIBDMO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC ZINC000554306311 1056055193 /nfs/dbraw/zinc/05/51/93/1056055193.db2.gz VZXBSVYXSFKRTD-QGZVFWFLSA-N 1 1 344.411 4.195 20 5 EIBDMO CC(C)C[N@H+](Cc1ccccc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000746061864 1059991100 /nfs/dbraw/zinc/99/11/00/1059991100.db2.gz LSQCSFIIQIFQKO-UHFFFAOYSA-N 1 1 338.411 4.060 20 5 EIBDMO C[C@@]1(Cc2ccccc2)CCC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC001168967843 1060563034 /nfs/dbraw/zinc/56/30/34/1060563034.db2.gz BQTXZRTVLUWKRB-IBGZPJMESA-N 1 1 328.387 4.331 20 5 EIBDMO CCCC1CCC([N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC001169952390 1061048701 /nfs/dbraw/zinc/04/87/01/1061048701.db2.gz GZDHLYWJLCTCHM-UHFFFAOYSA-N 1 1 347.459 4.214 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])CC[C@H]1c1ccccc1 ZINC000610216206 1019395681 /nfs/dbraw/zinc/39/56/81/1019395681.db2.gz ZRXWBPYKOMLOTE-GDBMZVCRSA-N 1 1 328.387 4.360 20 5 EIBDMO C[C@H]1C[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])CC[C@@H]1c1ccccc1 ZINC000610216208 1019396827 /nfs/dbraw/zinc/39/68/27/1019396827.db2.gz ZRXWBPYKOMLOTE-HOCLYGCPSA-N 1 1 328.387 4.360 20 5 EIBDMO CCOc1ccc([C@@H]2CCC[N@H+]2Cc2ccccc2[N+](=O)[O-])cc1 ZINC000015372237 1032844896 /nfs/dbraw/zinc/84/48/96/1032844896.db2.gz FWNUFYJTEBFJRI-SFHVURJKSA-N 1 1 326.396 4.331 20 5 EIBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1cccc(Cl)c1 ZINC000083128141 1020201327 /nfs/dbraw/zinc/20/13/27/1020201327.db2.gz WVMCWDLSNXNNOQ-UHFFFAOYSA-N 1 1 331.759 4.021 20 5 EIBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1cccc(Cl)c1 ZINC000083128141 1020201330 /nfs/dbraw/zinc/20/13/30/1020201330.db2.gz WVMCWDLSNXNNOQ-UHFFFAOYSA-N 1 1 331.759 4.021 20 5 EIBDMO CC[C@H]1CCCC[N@@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC001167158702 1020434327 /nfs/dbraw/zinc/43/43/27/1020434327.db2.gz WXRPZJDZQWFWQR-NSHDSACASA-N 1 1 327.222 4.122 20 5 EIBDMO CC[C@H]1CCCC[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC001167158702 1020434335 /nfs/dbraw/zinc/43/43/35/1020434335.db2.gz WXRPZJDZQWFWQR-NSHDSACASA-N 1 1 327.222 4.122 20 5 EIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc2cc(F)ccc2o1 ZINC000348639243 1021149099 /nfs/dbraw/zinc/14/90/99/1021149099.db2.gz YJKHUDIOBBASHW-UHFFFAOYSA-N 1 1 328.343 4.155 20 5 EIBDMO C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1nc2ccccc2n1C(F)F ZINC000548074422 1021837086 /nfs/dbraw/zinc/83/70/86/1021837086.db2.gz YQMUJULPNYXUNK-LLVKDONJSA-N 1 1 346.337 4.190 20 5 EIBDMO COc1ccc2oc(C[N@@H+](C)CCc3cccc([N+](=O)[O-])c3)cc2c1 ZINC000581442343 1021850585 /nfs/dbraw/zinc/85/05/85/1021850585.db2.gz ZYTOVZLHWKJRJP-UHFFFAOYSA-N 1 1 340.379 4.024 20 5 EIBDMO Cc1c([C@@H](C)[NH2+][C@@H](C)c2nc3c(s2)CCC3)cccc1[N+](=O)[O-] ZINC000414133595 1021915414 /nfs/dbraw/zinc/91/54/14/1021915414.db2.gz AOQUNCBULIWIOB-NEPJUHHUSA-N 1 1 331.441 4.260 20 5 EIBDMO CC(C)(C)OC1CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000119076562 1021961719 /nfs/dbraw/zinc/96/17/19/1021961719.db2.gz DNVWHSHKJGZIAD-UHFFFAOYSA-N 1 1 326.824 4.028 20 5 EIBDMO C[C@@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1nc2c(s1)CCC2 ZINC000414159178 1021991440 /nfs/dbraw/zinc/99/14/40/1021991440.db2.gz VSZGHLDTUUPSTO-ABAIWWIYSA-N 1 1 343.452 4.268 20 5 EIBDMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104666735 1022673933 /nfs/dbraw/zinc/67/39/33/1022673933.db2.gz VIGYAQRAMWPCCT-PBHICJAKSA-N 1 1 343.427 4.303 20 5 EIBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@]1(c2ccccc2)CCCCC1=O ZINC000472601041 1022790529 /nfs/dbraw/zinc/79/05/29/1022790529.db2.gz RHGKBJOOGNOKNV-FQEVSTJZSA-N 1 1 338.407 4.065 20 5 EIBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@]1(c2ccccc2)CCCCC1=O ZINC000472601041 1022790546 /nfs/dbraw/zinc/79/05/46/1022790546.db2.gz RHGKBJOOGNOKNV-FQEVSTJZSA-N 1 1 338.407 4.065 20 5 EIBDMO COc1ccc([C@@H](C)[N@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000541128293 1023501375 /nfs/dbraw/zinc/50/13/75/1023501375.db2.gz XSSYWHGLFLXOMG-GFCCVEGCSA-N 1 1 334.803 4.450 20 5 EIBDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000541128293 1023501386 /nfs/dbraw/zinc/50/13/86/1023501386.db2.gz XSSYWHGLFLXOMG-GFCCVEGCSA-N 1 1 334.803 4.450 20 5 EIBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@H]1CCCc2ccccc21 ZINC000610580822 1024108013 /nfs/dbraw/zinc/10/80/13/1024108013.db2.gz NUNVGFKICNPFBW-KRWDZBQOSA-N 1 1 337.379 4.245 20 5 EIBDMO C[C@@]1([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CCCc2ccccc21 ZINC000610582134 1024125017 /nfs/dbraw/zinc/12/50/17/1024125017.db2.gz XVEQPTWDVCKVEJ-LJQANCHMSA-N 1 1 337.379 4.077 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCO[C@H]4CCC[C@@H]43)s2)cc1 ZINC000510649865 1024162850 /nfs/dbraw/zinc/16/28/50/1024162850.db2.gz YPSOJFSZLWQXOQ-IRXDYDNUSA-N 1 1 344.436 4.077 20 5 EIBDMO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1cccc([N+](=O)[O-])c1C)CCC2 ZINC000111310849 1024359775 /nfs/dbraw/zinc/35/97/75/1024359775.db2.gz LGGQDADVVSJHED-INIZCTEOSA-N 1 1 331.441 4.178 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CC[C@@H]4CCCC[C@@H]43)o2)c1 ZINC000104680738 1024421789 /nfs/dbraw/zinc/42/17/89/1024421789.db2.gz VATNWJVSLCVOIX-YOEHRIQHSA-N 1 1 341.411 4.057 20 5 EIBDMO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccc(Br)cc1 ZINC000049515632 1024825905 /nfs/dbraw/zinc/82/59/05/1024825905.db2.gz BABIQLOQJJPTBQ-SECBINFHSA-N 1 1 341.230 4.270 20 5 EIBDMO CC[C@H]([NH2+][C@H]1COc2c1cccc2Cl)c1cccc([N+](=O)[O-])c1 ZINC000610831155 1025052913 /nfs/dbraw/zinc/05/29/13/1025052913.db2.gz DCOSUTXMQOZTAI-HOTGVXAUSA-N 1 1 332.787 4.423 20 5 EIBDMO CCc1ccc([C@H](COC)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)o1 ZINC000165261650 1025181389 /nfs/dbraw/zinc/18/13/89/1025181389.db2.gz XXJQSQLZMRXCHM-CJNGLKHVSA-N 1 1 332.400 4.097 20 5 EIBDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC001167503940 1025458839 /nfs/dbraw/zinc/45/88/39/1025458839.db2.gz GKZWXHZCIQLKNX-KZULUSFZSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 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CC(C)(O)C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC1 ZINC000428409302 1028726409 /nfs/dbraw/zinc/72/64/09/1028726409.db2.gz BGKAQSBOCWYEAN-UHFFFAOYSA-N 1 1 346.452 4.059 20 5 EIBDMO CCC[C@H]([NH2+][C@H](COC)c1ccc(C)o1)c1cccc([N+](=O)[O-])c1 ZINC000156453409 1028741740 /nfs/dbraw/zinc/74/17/40/1028741740.db2.gz UZQMAOCAXUIHQU-DLBZAZTESA-N 1 1 332.400 4.315 20 5 EIBDMO CC[C@]1(C)CCC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000245458096 1028859986 /nfs/dbraw/zinc/85/99/86/1028859986.db2.gz UTABCUCALHOWCQ-FZKQIMNGSA-N 1 1 344.415 4.218 20 5 EIBDMO CC(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2ccccn2)cc1[N+](=O)[O-] ZINC000535067583 1030034893 /nfs/dbraw/zinc/03/48/93/1030034893.db2.gz QGHGWHOEDPKVNV-GOSISDBHSA-N 1 1 325.412 4.450 20 5 EIBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H]2c2ccccn2)cc1[N+](=O)[O-] ZINC000535067583 1030034916 /nfs/dbraw/zinc/03/49/16/1030034916.db2.gz QGHGWHOEDPKVNV-GOSISDBHSA-N 1 1 325.412 4.450 20 5 EIBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CC[C@@H](c3cccc(F)c3)C2)c(F)c1 ZINC000509658345 1030241087 /nfs/dbraw/zinc/24/10/87/1030241087.db2.gz PJKSGZKAZDNGSH-GFCCVEGCSA-N 1 1 336.313 4.002 20 5 EIBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)c(F)c1 ZINC000509658345 1030241107 /nfs/dbraw/zinc/24/11/07/1030241107.db2.gz PJKSGZKAZDNGSH-GFCCVEGCSA-N 1 1 336.313 4.002 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3ccncc3Cl)C2)cc1 ZINC000451554095 1030572330 /nfs/dbraw/zinc/57/23/30/1030572330.db2.gz ZEZQWNJAFJGVEQ-AWEZNQCLSA-N 1 1 331.803 4.023 20 5 EIBDMO C[C@H]1CCCC[N@H+]1CCC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000532419418 1030932737 /nfs/dbraw/zinc/93/27/37/1030932737.db2.gz VABBIKXQTUYLQF-KRWDZBQOSA-N 1 1 345.487 4.071 20 5 EIBDMO C[C@H]1CCCC[N@@H+]1CCC1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000532419418 1030932758 /nfs/dbraw/zinc/93/27/58/1030932758.db2.gz VABBIKXQTUYLQF-KRWDZBQOSA-N 1 1 345.487 4.071 20 5 EIBDMO C[C@H]1CCCC[N@H+]1CCC1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000532419418 1030932794 /nfs/dbraw/zinc/93/27/94/1030932794.db2.gz VABBIKXQTUYLQF-KRWDZBQOSA-N 1 1 345.487 4.071 20 5 EIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H](C)CC(C)(C)C1 ZINC000612134824 1031029851 /nfs/dbraw/zinc/02/98/51/1031029851.db2.gz CWRGZEWZOJFCJU-STQMWFEESA-N 1 1 344.415 4.074 20 5 EIBDMO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000179930855 1031639642 /nfs/dbraw/zinc/63/96/42/1031639642.db2.gz PXTJAVQPVVNYDZ-JTQLQIEISA-N 1 1 338.766 4.247 20 5 EIBDMO Cc1cc([NH+]2CCCC2)ccc1NCCc1ccc([N+](=O)[O-])cc1 ZINC000612597935 1031690003 /nfs/dbraw/zinc/69/00/03/1031690003.db2.gz FZGGQMYDJIDUJE-UHFFFAOYSA-N 1 1 325.412 4.158 20 5 EIBDMO COC[C@]1(C)CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000449397883 1031701448 /nfs/dbraw/zinc/70/14/48/1031701448.db2.gz WGRGZKBLMGIFCA-GOSISDBHSA-N 1 1 346.452 4.182 20 5 EIBDMO CCO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C ZINC000449495019 1031803404 /nfs/dbraw/zinc/80/34/04/1031803404.db2.gz NTKLNKXAQTXCNX-KBXCAEBGSA-N 1 1 344.411 4.102 20 5 EIBDMO 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ZINC000595395756 1035666079 /nfs/dbraw/zinc/66/60/79/1035666079.db2.gz NQUIRFDLYGCJQQ-MRXNPFEDSA-N 1 1 329.400 4.352 20 5 EIBDMO CC[C@H](C)[N@@H+](C)CCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491050206 1035791575 /nfs/dbraw/zinc/79/15/75/1035791575.db2.gz GZXUAQCZSXGTHL-OXJNMPFZSA-N 1 1 341.455 4.004 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC([C@@H]2CCCCO2)CC1 ZINC000595789267 1035791739 /nfs/dbraw/zinc/79/17/39/1035791739.db2.gz QDNPUMKVLIVCHL-KRWDZBQOSA-N 1 1 338.835 4.029 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]([C@H]3CCCCO3)C2)c(Cl)c1 ZINC000595787994 1035794497 /nfs/dbraw/zinc/79/44/97/1035794497.db2.gz LQJIYPMQYUZWGM-WMLDXEAASA-N 1 1 338.835 4.029 20 5 EIBDMO CC(C)(C)CCOc1cnccc1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000571120534 1035953967 /nfs/dbraw/zinc/95/39/67/1035953967.db2.gz REARAYVUUAMSRZ-UHFFFAOYSA-N 1 1 343.427 4.095 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3C[C@@H]4CCCC[C@@H]43)cs2)c1 ZINC000597160101 1036138300 /nfs/dbraw/zinc/13/83/00/1036138300.db2.gz ZPFPMCKIXPUNBW-BBRMVZONSA-N 1 1 329.425 4.093 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3C[C@@H]4CCCC[C@@H]43)cs2)c1 ZINC000597160101 1036138319 /nfs/dbraw/zinc/13/83/19/1036138319.db2.gz ZPFPMCKIXPUNBW-BBRMVZONSA-N 1 1 329.425 4.093 20 5 EIBDMO CC[C@@H]1c2ccsc2CC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000485740625 1036233843 /nfs/dbraw/zinc/23/38/43/1036233843.db2.gz WYLHWOHALQBDDV-CQSZACIVSA-N 1 1 332.425 4.174 20 5 EIBDMO CC[C@@H]1c2ccsc2CC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000485740625 1036233863 /nfs/dbraw/zinc/23/38/63/1036233863.db2.gz WYLHWOHALQBDDV-CQSZACIVSA-N 1 1 332.425 4.174 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC000485797552 1036278914 /nfs/dbraw/zinc/27/89/14/1036278914.db2.gz YMNKDWQRDMYLLR-BEFAXECRSA-N 1 1 326.396 4.038 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC000485797552 1036278941 /nfs/dbraw/zinc/27/89/41/1036278941.db2.gz YMNKDWQRDMYLLR-BEFAXECRSA-N 1 1 326.396 4.038 20 5 EIBDMO CC1=C(c2ccco2)C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000366969706 1036447336 /nfs/dbraw/zinc/44/73/36/1036447336.db2.gz MZPFTRCNLIHAPV-UHFFFAOYSA-N 1 1 339.351 4.008 20 5 EIBDMO CC1=C(c2ccco2)C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000366969706 1036447356 /nfs/dbraw/zinc/44/73/56/1036447356.db2.gz MZPFTRCNLIHAPV-UHFFFAOYSA-N 1 1 339.351 4.008 20 5 EIBDMO C[C@H](C[N@@H+](C)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)(C)C ZINC000603057002 1036713967 /nfs/dbraw/zinc/71/39/67/1036713967.db2.gz YBAOMPHPVZFQBZ-OLZOCXBDSA-N 1 1 346.431 4.320 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cncc(Cl)c3)C2)cc1 ZINC000598620642 1036716484 /nfs/dbraw/zinc/71/64/84/1036716484.db2.gz MEPYNGYEAIVDEA-HNNXBMFYSA-N 1 1 331.803 4.023 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cncc(Cl)c3)C2)cc1 ZINC000598620643 1036717913 /nfs/dbraw/zinc/71/79/13/1036717913.db2.gz MEPYNGYEAIVDEA-OAHLLOKOSA-N 1 1 331.803 4.023 20 5 EIBDMO CCCCC[C@@H]1CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000486795178 1036855760 /nfs/dbraw/zinc/85/57/60/1036855760.db2.gz QCNPIZWCBAQKSV-OAHLLOKOSA-N 1 1 344.415 4.190 20 5 EIBDMO CC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1ccc(Cl)s1 ZINC000603661572 1036930216 /nfs/dbraw/zinc/93/02/16/1036930216.db2.gz FFNQDSCMJVRQBA-UHFFFAOYSA-N 1 1 340.832 4.211 20 5 EIBDMO Cc1ccc([C@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000603836951 1037032213 /nfs/dbraw/zinc/03/22/13/1037032213.db2.gz DCAMWXVHDIHRBM-QGZVFWFLSA-N 1 1 326.396 4.119 20 5 EIBDMO COc1ccc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000603856865 1037048943 /nfs/dbraw/zinc/04/89/43/1037048943.db2.gz YTMGRXYDCDFEQO-LBPRGKRZSA-N 1 1 334.803 4.450 20 5 EIBDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000603856865 1037048967 /nfs/dbraw/zinc/04/89/67/1037048967.db2.gz YTMGRXYDCDFEQO-LBPRGKRZSA-N 1 1 334.803 4.450 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@H]2CCc2ccccc2)cc1[N+](=O)[O-] ZINC000603855855 1037051190 /nfs/dbraw/zinc/05/11/90/1037051190.db2.gz ZDPNPKQWNKXECW-SFHVURJKSA-N 1 1 340.423 4.201 20 5 EIBDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000603856762 1037051413 /nfs/dbraw/zinc/05/14/13/1037051413.db2.gz WAOMLFPAABPTLP-LBPRGKRZSA-N 1 1 334.803 4.450 20 5 EIBDMO C[N@@H+](CCCOc1cccc(Cl)c1)Cc1cccc([N+](=O)[O-])c1 ZINC000603869782 1037065144 /nfs/dbraw/zinc/06/51/44/1037065144.db2.gz LYFGLZFGXAQBQC-UHFFFAOYSA-N 1 1 334.803 4.149 20 5 EIBDMO C[C@@H]1CCC[N@@H+](CCCCNc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000603860175 1037070527 /nfs/dbraw/zinc/07/05/27/1037070527.db2.gz YNGIHBWFXYWHLL-OAHLLOKOSA-N 1 1 342.443 4.067 20 5 EIBDMO C[C@]12CCCC[C@H]1C[N@H+]2Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000599670831 1037114288 /nfs/dbraw/zinc/11/42/88/1037114288.db2.gz KBEDRTZKXLGBLG-KSSFIOAISA-N 1 1 327.384 4.014 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](c2ccccn2)C1 ZINC000590599985 1037114622 /nfs/dbraw/zinc/11/46/22/1037114622.db2.gz INPBYQXFNFVGBK-HOTGVXAUSA-N 1 1 325.412 4.239 20 5 EIBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@@H]2c2cccc(F)c2)cc1 ZINC000604013534 1037147275 /nfs/dbraw/zinc/14/72/75/1037147275.db2.gz OCMWYXLKIZUHRT-LJQANCHMSA-N 1 1 344.386 4.340 20 5 EIBDMO COc1ccc([C@@H](C)[N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000604012473 1037147593 /nfs/dbraw/zinc/14/75/93/1037147593.db2.gz GSAKFUQQESTIBX-OAHLLOKOSA-N 1 1 344.411 4.065 20 5 EIBDMO COc1cccc(C[N@@H+](Cc2csc([N+](=O)[O-])c2)CC(C)C)c1 ZINC000604494703 1037407627 /nfs/dbraw/zinc/40/76/27/1037407627.db2.gz WBVOPBHRZOWFMW-UHFFFAOYSA-N 1 1 334.441 4.323 20 5 EIBDMO COc1cccc(C[N@H+](Cc2csc([N+](=O)[O-])c2)CC(C)C)c1 ZINC000604494703 1037407634 /nfs/dbraw/zinc/40/76/34/1037407634.db2.gz WBVOPBHRZOWFMW-UHFFFAOYSA-N 1 1 334.441 4.323 20 5 EIBDMO CC(C)(C)CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592131298 1037739893 /nfs/dbraw/zinc/73/98/93/1037739893.db2.gz WNGFCEGEBUZNDZ-QAQDUYKDSA-N 1 1 334.460 4.137 20 5 EIBDMO CC(C)c1ccc(C[N@H+]2CC3(C[C@@H]2C)CCOCC3)cc1[N+](=O)[O-] ZINC000592529447 1037825708 /nfs/dbraw/zinc/82/57/08/1037825708.db2.gz ZSTKHHDTTLTDRC-HNNXBMFYSA-N 1 1 332.444 4.109 20 5 EIBDMO CCCCC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)C ZINC000503704188 1037884498 /nfs/dbraw/zinc/88/44/98/1037884498.db2.gz UEHPNPLCYZIISC-UHFFFAOYSA-N 1 1 341.839 4.087 20 5 EIBDMO Cc1csc([C@@H]2CCC[N@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000249909140 1037890249 /nfs/dbraw/zinc/89/02/49/1037890249.db2.gz VPQOIYZFELTWJW-UKRRQHHQSA-N 1 1 331.441 4.300 20 5 EIBDMO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1OC ZINC000574192532 1037948854 /nfs/dbraw/zinc/94/88/54/1037948854.db2.gz IMEVPUNJWXODSW-SFHVURJKSA-N 1 1 344.411 4.195 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000490017010 1038315211 /nfs/dbraw/zinc/31/52/11/1038315211.db2.gz XESOBGCVZMUMIK-MAUKXSAKSA-N 1 1 325.412 4.232 20 5 EIBDMO C[C@H](O)C[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000537623381 1039004624 /nfs/dbraw/zinc/00/46/24/1039004624.db2.gz DSBDKBGFJGGHSZ-BBRMVZONSA-N 1 1 346.452 4.059 20 5 EIBDMO CC[C@H]1CCCC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000505362519 1039247149 /nfs/dbraw/zinc/24/71/49/1039247149.db2.gz PWXTXDOMRPBFTE-HNNXBMFYSA-N 1 1 331.441 4.483 20 5 EIBDMO CO[C@@H](C[N@@H+](C)Cc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000513896571 1039355658 /nfs/dbraw/zinc/35/56/58/1039355658.db2.gz ATZQANUUMROEBR-KRWDZBQOSA-N 1 1 334.803 4.068 20 5 EIBDMO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000534853574 1039813857 /nfs/dbraw/zinc/81/38/57/1039813857.db2.gz FZLGXJJTABUBPM-CQSZACIVSA-N 1 1 349.390 4.197 20 5 EIBDMO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000534853574 1039813858 /nfs/dbraw/zinc/81/38/58/1039813858.db2.gz FZLGXJJTABUBPM-CQSZACIVSA-N 1 1 349.390 4.197 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@H]3Cc3ccccc3)co2)cc1 ZINC000534842225 1039818088 /nfs/dbraw/zinc/81/80/88/1039818088.db2.gz SGTBIDGFSCKAMX-IBGZPJMESA-N 1 1 349.390 4.067 20 5 EIBDMO COc1cccc([C@H]2CCC[N@@H+]2Cc2c(F)cccc2[N+](=O)[O-])c1 ZINC000505608026 1040071506 /nfs/dbraw/zinc/07/15/06/1040071506.db2.gz GWQDYFCGSNCGTJ-QGZVFWFLSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1cccc([C@H]2CCC[N@H+]2Cc2c(F)cccc2[N+](=O)[O-])c1 ZINC000505608026 1040071521 /nfs/dbraw/zinc/07/15/21/1040071521.db2.gz GWQDYFCGSNCGTJ-QGZVFWFLSA-N 1 1 330.359 4.080 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(Cc2ccccc2)CC1 ZINC000505606150 1040077262 /nfs/dbraw/zinc/07/72/62/1040077262.db2.gz VECFOMUUXZBLGW-UHFFFAOYSA-N 1 1 328.387 4.189 20 5 EIBDMO C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000535562441 1040360408 /nfs/dbraw/zinc/36/04/08/1040360408.db2.gz XPEVXYQZNGANLT-CXAGYDPISA-N 1 1 329.400 4.260 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000515552884 1040850454 /nfs/dbraw/zinc/85/04/54/1040850454.db2.gz QJTXHGWWUNBOCD-KRWDZBQOSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000515552884 1040850456 /nfs/dbraw/zinc/85/04/56/1040850456.db2.gz QJTXHGWWUNBOCD-KRWDZBQOSA-N 1 1 330.359 4.080 20 5 EIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](CCC(F)(F)F)CC1CC1 ZINC000539910540 1040892914 /nfs/dbraw/zinc/89/29/14/1040892914.db2.gz CCDSXSPOEMWETH-UHFFFAOYSA-N 1 1 346.349 4.158 20 5 EIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](CCC(F)(F)F)CC1CC1 ZINC000539910540 1040892917 /nfs/dbraw/zinc/89/29/17/1040892917.db2.gz CCDSXSPOEMWETH-UHFFFAOYSA-N 1 1 346.349 4.158 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H]2COc3c2ccc(Cl)c3Cl)cc1 ZINC000516101131 1041394441 /nfs/dbraw/zinc/39/44/41/1041394441.db2.gz FKQNTTXCSFELPE-ZDUSSCGKSA-N 1 1 339.178 4.125 20 5 EIBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000007335640 1041447305 /nfs/dbraw/zinc/44/73/05/1041447305.db2.gz DWUCKVAOEJHTHG-CHWSQXEVSA-N 1 1 338.367 4.057 20 5 EIBDMO C[C@H]1CCC[C@H](C)[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000538726799 1041497565 /nfs/dbraw/zinc/49/75/65/1041497565.db2.gz YJQCWHAHASNPTR-GJZGRUSLSA-N 1 1 342.443 4.006 20 5 EIBDMO COc1cccc(C2=CC[N@H+]([C@H](C)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000437592634 1041847007 /nfs/dbraw/zinc/84/70/07/1041847007.db2.gz LZNHSZLPYLPWFF-OAHLLOKOSA-N 1 1 338.407 4.454 20 5 EIBDMO C[N@@H+](CC[C@H]1CCCO1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000467366835 1042116866 /nfs/dbraw/zinc/11/68/66/1042116866.db2.gz BDPBUZYARRPAPV-MRXNPFEDSA-N 1 1 346.452 4.324 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1ccon1 ZINC000541784886 1042118949 /nfs/dbraw/zinc/11/89/49/1042118949.db2.gz ZORCWPBFFILIRN-LLVKDONJSA-N 1 1 329.381 4.162 20 5 EIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](C(C)(C)C)C1 ZINC000542320317 1042387129 /nfs/dbraw/zinc/38/71/29/1042387129.db2.gz GBCBAMHJYRXUEL-GXTWGEPZSA-N 1 1 344.415 4.074 20 5 EIBDMO C[N@@H+](CCc1cccs1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549862608 1042440479 /nfs/dbraw/zinc/44/04/79/1042440479.db2.gz VYSUQYUFDGBTSC-UHFFFAOYSA-N 1 1 344.358 4.350 20 5 EIBDMO CC[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@H](C)Cc1ccc(OC)cc1 ZINC000506497771 1042524523 /nfs/dbraw/zinc/52/45/23/1042524523.db2.gz YTWHJKHGPDRZJF-CYBMUJFWSA-N 1 1 334.441 4.118 20 5 EIBDMO CC(C)([NH2+]Cc1nc2ccc(F)cc2s1)c1ccccc1[N+](=O)[O-] ZINC000492243116 1042588356 /nfs/dbraw/zinc/58/83/56/1042588356.db2.gz VWXAXIIMMVWLNY-UHFFFAOYSA-N 1 1 345.399 4.369 20 5 EIBDMO CCOc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(OCC)c2)cc1 ZINC000492356819 1042622759 /nfs/dbraw/zinc/62/27/59/1042622759.db2.gz LMPKWYOHBOPXJH-UHFFFAOYSA-N 1 1 344.411 4.024 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+]Cc2cnc(C(F)(F)F)s2)cc1[N+](=O)[O-] ZINC000443987043 1042728696 /nfs/dbraw/zinc/72/86/96/1042728696.db2.gz IEDJEKFGIWACEV-VIFPVBQESA-N 1 1 345.346 4.229 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1N1CCCC1 ZINC000506721849 1042809560 /nfs/dbraw/zinc/80/95/60/1042809560.db2.gz JHGGQPLBDZZUMC-MRXNPFEDSA-N 1 1 339.439 4.388 20 5 EIBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H](C)Cc1ccsc1 ZINC000614604120 1042914113 /nfs/dbraw/zinc/91/41/13/1042914113.db2.gz VHAQNZMQTYCBBA-LBPRGKRZSA-N 1 1 345.424 4.251 20 5 EIBDMO CCc1cccc(Cl)c1C[NH2+]Cc1cc([N+](=O)[O-])ccc1OC ZINC000474003073 1042985411 /nfs/dbraw/zinc/98/54/11/1042985411.db2.gz XJTTYKILNXNFAY-UHFFFAOYSA-N 1 1 334.803 4.109 20 5 EIBDMO COc1ccc(C[N@H+](C)Cc2ccc(Cl)c(F)c2)cc1[N+](=O)[O-] ZINC000536488401 1043038804 /nfs/dbraw/zinc/03/88/04/1043038804.db2.gz PFZOXDANOWCTHT-UHFFFAOYSA-N 1 1 338.766 4.028 20 5 EIBDMO COc1ccc(C[N@@H+](C)Cc2ccc(Cl)c(F)c2)cc1[N+](=O)[O-] ZINC000536488401 1043038813 /nfs/dbraw/zinc/03/88/13/1043038813.db2.gz PFZOXDANOWCTHT-UHFFFAOYSA-N 1 1 338.766 4.028 20 5 EIBDMO CC[C@@H]([NH2+]Cc1ccc(F)c(CN(C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000120947290 1043185572 /nfs/dbraw/zinc/18/55/72/1043185572.db2.gz ZEAVJPBVQHKGEC-LJQANCHMSA-N 1 1 345.418 4.036 20 5 EIBDMO CC(C)(O)[C@H]1CCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000428070332 1043316325 /nfs/dbraw/zinc/31/63/25/1043316325.db2.gz NWEVHJZIUGHHKU-QGZVFWFLSA-N 1 1 346.452 4.059 20 5 EIBDMO Cc1ccc[nH+]c1NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000130943750 1043330367 /nfs/dbraw/zinc/33/03/67/1043330367.db2.gz QQIADUAYPUBAIQ-UHFFFAOYSA-N 1 1 326.381 4.034 20 5 EIBDMO Cc1c(C[N@H+]2CCC[C@H]2Cc2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000521424607 1043764660 /nfs/dbraw/zinc/76/46/60/1043764660.db2.gz OFAMYUXZNCCSSF-SFHVURJKSA-N 1 1 328.387 4.249 20 5 EIBDMO Cc1c(C[N@H+](C)C2CCN(c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000439011812 1043799978 /nfs/dbraw/zinc/79/99/78/1043799978.db2.gz RNIWLAQQMYYBHF-UHFFFAOYSA-N 1 1 339.439 4.004 20 5 EIBDMO CCc1ccc([C@@H]([NH2+]CCC(F)(F)F)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542494671 1043983093 /nfs/dbraw/zinc/98/30/93/1043983093.db2.gz MUFLSVKXMRHGIA-HNNXBMFYSA-N 1 1 342.317 4.382 20 5 EIBDMO COc1c2ccccc2oc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000474044948 1044273904 /nfs/dbraw/zinc/27/39/04/1044273904.db2.gz OQGGRAQXASRJJR-LBPRGKRZSA-N 1 1 326.352 4.200 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc3ccccc3n2)c(Cl)c1 ZINC000543397891 1044513097 /nfs/dbraw/zinc/51/30/97/1044513097.db2.gz CVCXUNCTGZXZFZ-UHFFFAOYSA-N 1 1 327.771 4.086 20 5 EIBDMO Cc1cc(N[C@H]2CC[N@H+](C)[C@H]2c2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000301970630 1044529961 /nfs/dbraw/zinc/52/99/61/1044529961.db2.gz DVXYYXGKLROEEG-WMZOPIPTSA-N 1 1 347.365 4.039 20 5 EIBDMO Cc1cc(N[C@@H]2CC[N@H+](C)[C@H]2c2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000301970627 1044530277 /nfs/dbraw/zinc/53/02/77/1044530277.db2.gz DVXYYXGKLROEEG-AEFFLSMTSA-N 1 1 347.365 4.039 20 5 EIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+](Cc1ccc(F)cc1)CC1CC1 ZINC000734488312 1044583850 /nfs/dbraw/zinc/58/38/50/1044583850.db2.gz VDMHWVHCKVMQTP-UHFFFAOYSA-N 1 1 332.350 4.285 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2scnc2C2CC2)C2CC2)c1 ZINC000495070303 1044644669 /nfs/dbraw/zinc/64/46/69/1044644669.db2.gz VHKPMPUACQYNIR-UHFFFAOYSA-N 1 1 329.425 4.093 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2scnc2C2CC2)C2CC2)c1 ZINC000495070303 1044644680 /nfs/dbraw/zinc/64/46/80/1044644680.db2.gz VHKPMPUACQYNIR-UHFFFAOYSA-N 1 1 329.425 4.093 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2c[nH]nc2-c2ccccc2)C2CC2)cc1 ZINC000154256655 1044752296 /nfs/dbraw/zinc/75/22/96/1044752296.db2.gz RCKHORSKCZKEGD-UHFFFAOYSA-N 1 1 348.406 4.150 20 5 EIBDMO C[N@@H+](CCC1CCOCC1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000129652164 1044779197 /nfs/dbraw/zinc/77/91/97/1044779197.db2.gz PDXWCLQPWOXZTO-UHFFFAOYSA-N 1 1 344.411 4.103 20 5 EIBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)CC1CCOCC1 ZINC000093284645 1044829447 /nfs/dbraw/zinc/82/94/47/1044829447.db2.gz YILHMWQQNJXDJZ-UHFFFAOYSA-N 1 1 346.452 4.182 20 5 EIBDMO CCOC[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000093838969 1044857225 /nfs/dbraw/zinc/85/72/25/1044857225.db2.gz QVGYGFDFNZHDMJ-AWEZNQCLSA-N 1 1 346.452 4.182 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC000125502496 1045007648 /nfs/dbraw/zinc/00/76/48/1045007648.db2.gz OJSLFYJMBIXINS-SFHVURJKSA-N 1 1 341.411 4.114 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000125502496 1045007657 /nfs/dbraw/zinc/00/76/57/1045007657.db2.gz OJSLFYJMBIXINS-SFHVURJKSA-N 1 1 341.411 4.114 20 5 EIBDMO COc1ccc(C2CC[NH+](Cc3c(F)cccc3[N+](=O)[O-])CC2)cc1 ZINC000466743041 1045169085 /nfs/dbraw/zinc/16/90/85/1045169085.db2.gz IWALSGZTYQPKNT-UHFFFAOYSA-N 1 1 344.386 4.122 20 5 EIBDMO CC[C@H]([NH2+]Cc1nsc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC001168741026 1045222383 /nfs/dbraw/zinc/22/23/83/1045222383.db2.gz CWJFRWNJPQYJIN-HNNXBMFYSA-N 1 1 327.409 4.445 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@H]2CCOc3ccccc32)C2CC2)cc1 ZINC000611254765 1045266903 /nfs/dbraw/zinc/26/69/03/1045266903.db2.gz QVKLFDNQJDFBAZ-MRXNPFEDSA-N 1 1 338.407 4.126 20 5 EIBDMO C[N@@H+](CCOC(C)(C)C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000611274694 1045271659 /nfs/dbraw/zinc/27/16/59/1045271659.db2.gz ICNPCOCFIJIEHN-UHFFFAOYSA-N 1 1 332.400 4.102 20 5 EIBDMO CCC[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 ZINC000611376555 1045297129 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20 5 EIBDMO CCC[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C[C@H]1CCCCO1 ZINC000768541564 1045818541 /nfs/dbraw/zinc/81/85/41/1045818541.db2.gz IXWYFZKKELBCNG-CQSZACIVSA-N 1 1 326.824 4.029 20 5 EIBDMO Cc1noc(C[N@H+](CC(C)C)[C@@H](C)c2ccccc2C)c1[N+](=O)[O-] ZINC001170245517 1045950363 /nfs/dbraw/zinc/95/03/63/1045950363.db2.gz WQWBRWZESUCBNK-HNNXBMFYSA-N 1 1 331.416 4.419 20 5 EIBDMO CC[C@@H]1CC[C@H](C)[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC001170280823 1045988595 /nfs/dbraw/zinc/98/85/95/1045988595.db2.gz SIRDGDBJNZXBJR-NWDGAFQWSA-N 1 1 341.249 4.368 20 5 EIBDMO COc1ccc(C[C@@H](C)[N@@H+]2Cc3ccccc3[C@H](C)C2)c([N+](=O)[O-])c1 ZINC001170329598 1046002917 /nfs/dbraw/zinc/00/29/17/1046002917.db2.gz SBAYMLUSJUNZFY-HUUCEWRRSA-N 1 1 340.423 4.154 20 5 EIBDMO COCCOC[C@@H]1CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000769509348 1046003915 /nfs/dbraw/zinc/00/39/15/1046003915.db2.gz WTXBLGXLSNTQDD-GOSISDBHSA-N 1 1 349.474 4.478 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H](C)Cc1ccsc1 ZINC000792880746 1046090453 /nfs/dbraw/zinc/09/04/53/1046090453.db2.gz UOBBWXXFUWQTAJ-LBPRGKRZSA-N 1 1 349.412 4.018 20 5 EIBDMO C[N@H+](Cc1ccc[nH]1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000536667650 1046619238 /nfs/dbraw/zinc/61/92/38/1046619238.db2.gz NCKWUJWGGNRHDB-UHFFFAOYSA-N 1 1 345.786 4.468 20 5 EIBDMO C[N@@H+](Cc1ccc[nH]1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000536667650 1046619246 /nfs/dbraw/zinc/61/92/46/1046619246.db2.gz NCKWUJWGGNRHDB-UHFFFAOYSA-N 1 1 345.786 4.468 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)c1nc2c(s1)CCC2 ZINC000459634164 1046825398 /nfs/dbraw/zinc/82/53/98/1046825398.db2.gz QINNALXVZFCDLO-NEPJUHHUSA-N 1 1 331.441 4.260 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC000609280606 1047486792 /nfs/dbraw/zinc/48/67/92/1047486792.db2.gz FWYBFWISSGIWEU-MRXNPFEDSA-N 1 1 328.387 4.189 20 5 EIBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000919722061 1048031132 /nfs/dbraw/zinc/03/11/32/1048031132.db2.gz SJQAPVPXPQYGKD-VNHYZAJKSA-N 1 1 337.851 4.090 20 5 EIBDMO CC[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C1CC(C)(C)C1 ZINC001171087236 1048087264 /nfs/dbraw/zinc/08/72/64/1048087264.db2.gz NZBHNRKKDDAEDR-UHFFFAOYSA-N 1 1 341.249 4.368 20 5 EIBDMO CC(C)[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CCOCC1 ZINC000557010942 1048390077 /nfs/dbraw/zinc/39/00/77/1048390077.db2.gz FEMIZGOOKWCYOL-UHFFFAOYSA-N 1 1 346.349 4.003 20 5 EIBDMO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccncc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815565822 1048512899 /nfs/dbraw/zinc/51/28/99/1048512899.db2.gz BEQRFFGYPOEBML-VLIAUNLRSA-N 1 1 348.406 4.012 20 5 EIBDMO CC(C)OCCC[N@@H+](C)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809948241 1048577200 /nfs/dbraw/zinc/57/72/00/1048577200.db2.gz AXJJENUOJNVUFX-UHFFFAOYSA-N 1 1 335.231 4.149 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3C[C@H]4[C@@H](C3)C4(F)F)s2)cc1 ZINC000846112912 1048815815 /nfs/dbraw/zinc/81/58/15/1048815815.db2.gz UXWHLYNQGBKKOT-OKILXGFUSA-N 1 1 336.363 4.020 20 5 EIBDMO COc1ccccc1C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811472842 1049094384 /nfs/dbraw/zinc/09/43/84/1049094384.db2.gz OTIWZUNQYYQLCF-UHFFFAOYSA-N 1 1 341.194 4.200 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccnc(Cl)c1Cl)c1cccc([N+](=O)[O-])c1 ZINC000811474939 1049095811 /nfs/dbraw/zinc/09/58/11/1049095811.db2.gz UHSQQYBEVYFMIW-SECBINFHSA-N 1 1 326.183 4.147 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000609541274 1049143201 /nfs/dbraw/zinc/14/32/01/1049143201.db2.gz BMONSHQMTKJBJW-ZDUSSCGKSA-N 1 1 334.778 4.377 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000609916185 1049395017 /nfs/dbraw/zinc/39/50/17/1049395017.db2.gz DKVNTJKHNYSCQV-HOCLYGCPSA-N 1 1 328.387 4.360 20 5 EIBDMO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000610002007 1049468518 /nfs/dbraw/zinc/46/85/18/1049468518.db2.gz TUTPRUXSCGAYIM-BBRMVZONSA-N 1 1 344.415 4.045 20 5 EIBDMO CN(C(=O)c1c2ccccc2cc2ccccc21)[C@@H]1CCC[N@@H+](C)C1 ZINC000813025477 1049662791 /nfs/dbraw/zinc/66/27/91/1049662791.db2.gz RXTWVZUTRCTQPW-GOSISDBHSA-N 1 1 332.447 4.159 20 5 EIBDMO COc1cc(C[N@H+]2CCC[C@@H]2CC2CCCC2)c([N+](=O)[O-])cc1F ZINC001171630681 1049761919 /nfs/dbraw/zinc/76/19/19/1049761919.db2.gz CYZLNTAQQBAMOE-OAHLLOKOSA-N 1 1 336.407 4.287 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCC[C@H]1c1ccncc1)CC2 ZINC001172915842 1050231620 /nfs/dbraw/zinc/23/16/20/1050231620.db2.gz PERJPAJYUCGKQJ-QUCCMNQESA-N 1 1 337.423 4.074 20 5 EIBDMO C[C@H]1CC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCC1(F)F ZINC001172909695 1050246447 /nfs/dbraw/zinc/24/64/47/1050246447.db2.gz UXVIGGXOISIIPS-XJKSGUPXSA-N 1 1 338.398 4.209 20 5 EIBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNc1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC001186368207 1050299996 /nfs/dbraw/zinc/29/99/96/1050299996.db2.gz PAKDWZIRDHMMDT-CQSZACIVSA-N 1 1 345.365 4.146 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2csc(-c3ccoc3)n2)cc1[N+](=O)[O-] ZINC000181832461 1050348146 /nfs/dbraw/zinc/34/81/46/1050348146.db2.gz JQSURCSAHHUBPF-GFCCVEGCSA-N 1 1 343.408 4.471 20 5 EIBDMO COc1ccccc1C[C@H](C)[N@@H+](C)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173231864 1050360841 /nfs/dbraw/zinc/36/08/41/1050360841.db2.gz OEOCZKLIINSKNS-HOTGVXAUSA-N 1 1 342.439 4.097 20 5 EIBDMO COc1ccccc1[C@H](C)[N@@H+](C)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173234203 1050363421 /nfs/dbraw/zinc/36/34/21/1050363421.db2.gz PVJXTSDXYMNHDI-GJZGRUSLSA-N 1 1 328.412 4.227 20 5 EIBDMO Cc1ncc([C@H](C)[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)s1 ZINC001179333353 1050678036 /nfs/dbraw/zinc/67/80/36/1050678036.db2.gz VLBQLUMJKSPUDR-NSHDSACASA-N 1 1 343.408 4.471 20 5 EIBDMO C[C@H](C1CC1)[N@@H+](Cc1cc(Br)c([N+](=O)[O-])s1)C1CC1 ZINC001180178005 1050894296 /nfs/dbraw/zinc/89/42/96/1050894296.db2.gz LBWGWYADEXOAMY-MRVPVSSYSA-N 1 1 345.262 4.182 20 5 EIBDMO C[C@H]([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccsc1 ZINC000619782593 1050901451 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1051881211 /nfs/dbraw/zinc/88/12/11/1051881211.db2.gz ILLWEKXQEUVUOU-OIQJVACTSA-N 1 1 343.452 4.253 20 5 EIBDMO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]2C ZINC001193271977 1051893236 /nfs/dbraw/zinc/89/32/36/1051893236.db2.gz CZQROORCQNJRSQ-UONOGXRCSA-N 1 1 326.396 4.111 20 5 EIBDMO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]2C ZINC001193271977 1051893246 /nfs/dbraw/zinc/89/32/46/1051893246.db2.gz CZQROORCQNJRSQ-UONOGXRCSA-N 1 1 326.396 4.111 20 5 EIBDMO O=[N+]([O-])c1ccc(OCC[N@@H+](Cc2cccc(F)c2)C2CCC2)cc1 ZINC001176304565 1052008736 /nfs/dbraw/zinc/00/87/36/1052008736.db2.gz FUFHQRXZYSWCCU-UHFFFAOYSA-N 1 1 344.386 4.167 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](c2ccc(C)cc2)C[C@@H]1C ZINC001193931172 1052024549 /nfs/dbraw/zinc/02/45/49/1052024549.db2.gz MLNOFISNVQCLSF-RDJZCZTQSA-N 1 1 340.423 4.290 20 5 EIBDMO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC001194107646 1052077279 /nfs/dbraw/zinc/07/72/79/1052077279.db2.gz KGTDOTHZUFKDDY-IBGZPJMESA-N 1 1 344.411 4.065 20 5 EIBDMO C[C@H]1C[C@H](c2ccccc2)[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC001194153147 1052087860 /nfs/dbraw/zinc/08/78/60/1052087860.db2.gz MPCYCBAVWFORTL-KPZWWZAWSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@H]1C[C@H](c2ccccc2)[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC001194153147 1052087875 /nfs/dbraw/zinc/08/78/75/1052087875.db2.gz MPCYCBAVWFORTL-KPZWWZAWSA-N 1 1 332.350 4.456 20 5 EIBDMO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1 ZINC000774831271 1052179629 /nfs/dbraw/zinc/17/96/29/1052179629.db2.gz FCDPNZYVMMKOEX-KRWDZBQOSA-N 1 1 341.367 4.149 20 5 EIBDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1 ZINC000774831271 1052179635 /nfs/dbraw/zinc/17/96/35/1052179635.db2.gz FCDPNZYVMMKOEX-KRWDZBQOSA-N 1 1 341.367 4.149 20 5 EIBDMO CC[N@@H+](C[C@H](O)c1ccc(C)cc1)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000764282157 1053052024 /nfs/dbraw/zinc/05/20/24/1053052024.db2.gz CIPIAKCNYJMWRM-BEFAXECRSA-N 1 1 328.412 4.020 20 5 EIBDMO COc1cccc(C2([NH2+]Cc3cc([N+](=O)[O-])ccc3Cl)CCC2)c1 ZINC000850404670 1053175980 /nfs/dbraw/zinc/17/59/80/1053175980.db2.gz CHACNDDPQDETDL-UHFFFAOYSA-N 1 1 346.814 4.426 20 5 EIBDMO CC[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC)c1ccccc1OC ZINC000850423007 1053190338 /nfs/dbraw/zinc/19/03/38/1053190338.db2.gz KRUYSHCPNFDUSR-SUMWQHHRSA-N 1 1 344.411 4.414 20 5 EIBDMO CC(C)(C)C[C@@H]1CC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1(C)C ZINC001195064295 1053251212 /nfs/dbraw/zinc/25/12/12/1053251212.db2.gz CMUVBTWMVNPZKG-AWEZNQCLSA-N 1 1 347.459 4.070 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2c(Cl)cccc2OC(F)F)cc1 ZINC000112709830 1053286643 /nfs/dbraw/zinc/28/66/43/1053286643.db2.gz KZOSPNRSFKONSG-UHFFFAOYSA-N 1 1 342.729 4.139 20 5 EIBDMO C[C@@]1(c2cccc(F)c2)CC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC001195842560 1053501614 /nfs/dbraw/zinc/50/16/14/1053501614.db2.gz GGLNKUBLQKGXIO-GOSISDBHSA-N 1 1 332.350 4.037 20 5 EIBDMO C[C@@]1(c2cccc(F)c2)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC001195842560 1053501623 /nfs/dbraw/zinc/50/16/23/1053501623.db2.gz GGLNKUBLQKGXIO-GOSISDBHSA-N 1 1 332.350 4.037 20 5 EIBDMO Cc1ccc([C@H]2CCCC[N@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776585319 1053561760 /nfs/dbraw/zinc/56/17/60/1053561760.db2.gz VFXFPIHOYBUHLF-WOJBJXKFSA-N 1 1 340.423 4.164 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](Cc1ccccc1F)CC1CC1 ZINC001196239067 1053624228 /nfs/dbraw/zinc/62/42/28/1053624228.db2.gz XACHDOYTPRLTJS-UHFFFAOYSA-N 1 1 344.386 4.155 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](Cc1ccccc1F)CC1CC1 ZINC001196239067 1053624232 /nfs/dbraw/zinc/62/42/32/1053624232.db2.gz XACHDOYTPRLTJS-UHFFFAOYSA-N 1 1 344.386 4.155 20 5 EIBDMO CC(C)([NH2+]Cc1ccccc1[N+](=O)[O-])c1nc2ccccc2s1 ZINC001196488384 1053681211 /nfs/dbraw/zinc/68/12/11/1053681211.db2.gz AFPZNMZQFYTFNC-UHFFFAOYSA-N 1 1 327.409 4.229 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1ccns1 ZINC001203307277 1053726319 /nfs/dbraw/zinc/72/63/19/1053726319.db2.gz PFWOUBZTXUQAFT-LLVKDONJSA-N 1 1 329.381 4.162 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1noc3cc(F)ccc31)CCC2 ZINC000866612306 1053804355 /nfs/dbraw/zinc/80/43/55/1053804355.db2.gz GOZDURCRDRAJHS-MRXNPFEDSA-N 1 1 341.342 4.042 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@@]2(C)c2ccccc2)cc1[N+](=O)[O-] ZINC001197342689 1053878360 /nfs/dbraw/zinc/87/83/60/1053878360.db2.gz QQMMDNZFPFUYNT-IBGZPJMESA-N 1 1 326.396 4.115 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](C)[C@H]1c1ccccc1 ZINC001197661370 1053960306 /nfs/dbraw/zinc/96/03/06/1053960306.db2.gz UTKLFGQQKTXJRP-KUHUBIRLSA-N 1 1 326.396 4.187 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C)[C@H]1c1ccccc1 ZINC001197661371 1053961785 /nfs/dbraw/zinc/96/17/85/1053961785.db2.gz UTKLFGQQKTXJRP-LIRRHRJNSA-N 1 1 326.396 4.187 20 5 EIBDMO Cc1csc(C[C@@H]2CC[N@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC001198084063 1054068538 /nfs/dbraw/zinc/06/85/38/1054068538.db2.gz FRFUFICSFDMOJA-GJZGRUSLSA-N 1 1 345.468 4.294 20 5 EIBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(C(F)(F)F)nc1 ZINC000871935415 1054325708 /nfs/dbraw/zinc/32/57/08/1054325708.db2.gz XCKDIGZWTMXJTD-MNOVXSKESA-N 1 1 339.317 4.420 20 5 EIBDMO COc1ccc([C@H](C)[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1F ZINC000872018904 1054333546 /nfs/dbraw/zinc/33/35/46/1054333546.db2.gz QWIMFSLVXDWLBA-QWRGUYRKSA-N 1 1 336.338 4.293 20 5 EIBDMO Cc1nc2c(s1)[C@@H]([NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])CCC2 ZINC000872060208 1054371025 /nfs/dbraw/zinc/37/10/25/1054371025.db2.gz NUZZAHYVFZYDQQ-SKDRFNHKSA-N 1 1 335.404 4.227 20 5 EIBDMO CCCNc1ccc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872065490 1054374196 /nfs/dbraw/zinc/37/41/96/1054374196.db2.gz CEPCJRYYAXNEDO-CYBMUJFWSA-N 1 1 331.391 4.407 20 5 EIBDMO COCCc1cc[nH+]c(N[C@H](C)c2cc([N+](=O)[O-])ccc2SC)c1 ZINC000872071655 1054378396 /nfs/dbraw/zinc/37/83/96/1054378396.db2.gz TWWOHNWPHKMPLX-GFCCVEGCSA-N 1 1 347.440 4.074 20 5 EIBDMO Cc1c(CNCc2cccc(C[N@@H+](C)C(C)C)c2)cccc1[N+](=O)[O-] ZINC000873026450 1054478673 /nfs/dbraw/zinc/47/86/73/1054478673.db2.gz LKTOKZMIWNXIIG-UHFFFAOYSA-N 1 1 341.455 4.033 20 5 EIBDMO Cc1c(CNCc2cccc(C[N@H+](C)C(C)C)c2)cccc1[N+](=O)[O-] ZINC000873026450 1054478676 /nfs/dbraw/zinc/47/86/76/1054478676.db2.gz LKTOKZMIWNXIIG-UHFFFAOYSA-N 1 1 341.455 4.033 20 5 EIBDMO COc1cc(F)c([C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000173416726 1054897209 /nfs/dbraw/zinc/89/72/09/1054897209.db2.gz HUYYMZJCGIKCPN-VXGBXAGGSA-N 1 1 348.374 4.163 20 5 EIBDMO Cc1ccc([C@H]2CCC[N@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1C ZINC000776279942 1055150866 /nfs/dbraw/zinc/15/08/66/1055150866.db2.gz VDWYEIWJNPKUAS-UXHICEINSA-N 1 1 340.423 4.082 20 5 EIBDMO C[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CCC(C)(C)CC1 ZINC000878184672 1055202128 /nfs/dbraw/zinc/20/21/28/1055202128.db2.gz YTTWJXROELFCIM-UHFFFAOYSA-N 1 1 344.415 4.045 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+][C@H]2CCCc3cn(C(C)C)nc32)cc1[N+](=O)[O-] ZINC000765825824 1055805413 /nfs/dbraw/zinc/80/54/13/1055805413.db2.gz WKRFTZYDOKVGQW-PBHICJAKSA-N 1 1 342.443 4.409 20 5 EIBDMO COCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1C)[C@@H](C)c1ccccc1 ZINC000542701512 1055842945 /nfs/dbraw/zinc/84/29/45/1055842945.db2.gz FVOIFGXROKMWJA-INIZCTEOSA-N 1 1 328.412 4.113 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1cccc(OC(F)F)c1 ZINC001168686254 1056734289 /nfs/dbraw/zinc/73/42/89/1056734289.db2.gz QQMRHNSAMORCAV-SNVBAGLBSA-N 1 1 340.301 4.186 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC[C@@H]1c1ccccc1 ZINC000741807680 1058377485 /nfs/dbraw/zinc/37/74/85/1058377485.db2.gz JZUGMDZKUYONBQ-KDOFPFPSSA-N 1 1 328.387 4.360 20 5 EIBDMO C[C@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000743855102 1059161411 /nfs/dbraw/zinc/16/14/11/1059161411.db2.gz YQJCMGJTJGRJFP-SGTLLEGYSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000743855102 1059161434 /nfs/dbraw/zinc/16/14/34/1059161434.db2.gz YQJCMGJTJGRJFP-SGTLLEGYSA-N 1 1 332.350 4.456 20 5 EIBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@@H](c3cccc(Cl)c3Cl)C2)C1 ZINC001169035908 1060594538 /nfs/dbraw/zinc/59/45/38/1060594538.db2.gz MGMPLSUKMMDXAT-UPJWGTAASA-N 1 1 343.254 4.228 20 5 EIBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC001169048366 1060602898 /nfs/dbraw/zinc/60/28/98/1060602898.db2.gz UWFKAZCZFNCUJF-WQVCFCJDSA-N 1 1 342.361 4.288 20 5 EIBDMO CCC1(CC)CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC001169299155 1060762395 /nfs/dbraw/zinc/76/23/95/1060762395.db2.gz BVNHEBFGWQIEQG-UHFFFAOYSA-N 1 1 347.459 4.216 20 5 EIBDMO C[N@H+](CCCOCc1ccccc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC001169655446 1060889363 /nfs/dbraw/zinc/88/93/63/1060889363.db2.gz FRIBVAGFYARXOH-UHFFFAOYSA-N 1 1 348.830 4.287 20 5 EIBDMO C[N@@H+](CCCOCc1ccccc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC001169655446 1060889368 /nfs/dbraw/zinc/88/93/68/1060889368.db2.gz FRIBVAGFYARXOH-UHFFFAOYSA-N 1 1 348.830 4.287 20 5 EIBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Br)c1ccsc1 ZINC001169715244 1060915634 /nfs/dbraw/zinc/91/56/34/1060915634.db2.gz KFZFJPTZFBEGDL-VIFPVBQESA-N 1 1 341.230 4.270 20 5 EIBDMO COc1cccc(C=C2CC[NH+](Cc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000532381164 1032476587 /nfs/dbraw/zinc/47/65/87/1032476587.db2.gz WLLHPRKSGPJDTB-UHFFFAOYSA-N 1 1 338.407 4.283 20 5 EIBDMO O=[N+]([O-])c1cccc(OCC[N@@H+](Cc2ccc(Cl)cc2)C2CC2)c1 ZINC001167062394 1019160319 /nfs/dbraw/zinc/16/03/19/1019160319.db2.gz JZDIQIOJPYDCAD-UHFFFAOYSA-N 1 1 346.814 4.292 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H](C)c1ccc(F)c(F)c1 ZINC000430216736 1019432898 /nfs/dbraw/zinc/43/28/98/1019432898.db2.gz GHMFNXYWLDXJQO-NSHDSACASA-N 1 1 336.338 4.075 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H](C)c1ccc(F)c(F)c1 ZINC000430216736 1019432904 /nfs/dbraw/zinc/43/29/04/1019432904.db2.gz GHMFNXYWLDXJQO-NSHDSACASA-N 1 1 336.338 4.075 20 5 EIBDMO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1cccc(OC(F)(F)F)c1 ZINC000175754785 1019506601 /nfs/dbraw/zinc/50/66/01/1019506601.db2.gz ZQQMKIQPWBNNEF-SECBINFHSA-N 1 1 346.330 4.406 20 5 EIBDMO C[C@@H]1CCC[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001167226697 1020604234 /nfs/dbraw/zinc/60/42/34/1020604234.db2.gz AAHQJXVDCNQILB-YPMHNXCESA-N 1 1 341.249 4.368 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000581230417 1021838160 /nfs/dbraw/zinc/83/81/60/1021838160.db2.gz DUKCIEYNNVEWNI-GMMCIKNFSA-N 1 1 328.334 4.272 20 5 EIBDMO C[C@H](CCN[C@@H](C)c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000379635506 1021846190 /nfs/dbraw/zinc/84/61/90/1021846190.db2.gz WFWVNABPEOQOKJ-SJORKVTESA-N 1 1 341.455 4.156 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@H]1CCOc2ccc(F)cc21 ZINC000275879170 1021994276 /nfs/dbraw/zinc/99/42/76/1021994276.db2.gz WJSUBKOVMMCVII-AWEZNQCLSA-N 1 1 336.750 4.001 20 5 EIBDMO CCOc1cc(C[N@H+]2C[C@H](c3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC001167396953 1022007206 /nfs/dbraw/zinc/00/72/06/1022007206.db2.gz DCHWSUDNONGHOC-MAUKXSAKSA-N 1 1 340.423 4.372 20 5 EIBDMO COc1ccc(C[N@H+]2CCCCC[C@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000120439270 1033033158 /nfs/dbraw/zinc/03/31/58/1033033158.db2.gz XLWGWCWREQPKGA-KRWDZBQOSA-N 1 1 341.411 4.116 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@H](C(F)(F)F)C3(CCC3)C2)c1 ZINC000579855807 1022500257 /nfs/dbraw/zinc/50/02/57/1022500257.db2.gz GCTHDVMTSFULDT-AWEZNQCLSA-N 1 1 328.334 4.149 20 5 EIBDMO CCC(CC)[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)CC(C)C ZINC000177866580 1022734624 /nfs/dbraw/zinc/73/46/24/1022734624.db2.gz YCZGWPWHHODAQL-UHFFFAOYSA-N 1 1 346.431 4.291 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]3CCC[C@@H]32)ccc1Br ZINC000157816417 1023040988 /nfs/dbraw/zinc/04/09/88/1023040988.db2.gz FZYLKPNPTSKSED-OCCSQVGLSA-N 1 1 339.233 4.122 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)ccc1Br ZINC000157816417 1023040992 /nfs/dbraw/zinc/04/09/92/1023040992.db2.gz FZYLKPNPTSKSED-OCCSQVGLSA-N 1 1 339.233 4.122 20 5 EIBDMO CCCCc1nc(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cs1 ZINC000549154097 1023388048 /nfs/dbraw/zinc/38/80/48/1023388048.db2.gz SIRHLTUIMXCMON-UHFFFAOYSA-N 1 1 333.457 4.068 20 5 EIBDMO CCCCc1nc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cs1 ZINC000549154097 1023388060 /nfs/dbraw/zinc/38/80/60/1023388060.db2.gz SIRHLTUIMXCMON-UHFFFAOYSA-N 1 1 333.457 4.068 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@H]2Cc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000500172615 1023566348 /nfs/dbraw/zinc/56/63/48/1023566348.db2.gz NMEVVGDJHIUICJ-SFHVURJKSA-N 1 1 340.423 4.119 20 5 EIBDMO CC(C)(C)c1csc(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])n1 ZINC000581676652 1023580599 /nfs/dbraw/zinc/58/05/99/1023580599.db2.gz CSUIYTJCYJUXQB-CYBMUJFWSA-N 1 1 331.441 4.126 20 5 EIBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCCOC2)cc1[N+](=O)[O-] ZINC000566797706 1023817341 /nfs/dbraw/zinc/81/73/41/1023817341.db2.gz MJKPNQNBSQJXTP-SJLPKXTDSA-N 1 1 332.444 4.109 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](c3nc4ccccc4o3)C2)cs1 ZINC000047265872 1023879687 /nfs/dbraw/zinc/87/96/87/1023879687.db2.gz OIGYCSZZMMTKEZ-ZDUSSCGKSA-N 1 1 343.408 4.177 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCO[C@@H]4CCC[C@@H]43)s2)cc1 ZINC000510649863 1024164987 /nfs/dbraw/zinc/16/49/87/1024164987.db2.gz YPSOJFSZLWQXOQ-DLBZAZTESA-N 1 1 344.436 4.077 20 5 EIBDMO CCOc1cc(C[NH2+][C@H](C)c2cccc(F)c2F)ccc1[N+](=O)[O-] ZINC000276840922 1024499148 /nfs/dbraw/zinc/49/91/48/1024499148.db2.gz CGOFSCUUAUHSNQ-LLVKDONJSA-N 1 1 336.338 4.123 20 5 EIBDMO CCOc1cc(C[NH2+][C@@H](C)c2ccc(F)cc2F)ccc1[N+](=O)[O-] ZINC000276922172 1024759189 /nfs/dbraw/zinc/75/91/89/1024759189.db2.gz PILXSFUGQIVFJF-NSHDSACASA-N 1 1 336.338 4.123 20 5 EIBDMO CC(C)(CO)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000568565005 1025199506 /nfs/dbraw/zinc/19/95/06/1025199506.db2.gz FBZQXAKVKDFJJF-QGZVFWFLSA-N 1 1 348.830 4.098 20 5 EIBDMO COc1cccc(C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)c1 ZINC000519160599 1025545510 /nfs/dbraw/zinc/54/55/10/1025545510.db2.gz QKUFIAQHIQSOKS-UHFFFAOYSA-N 1 1 344.411 4.023 20 5 EIBDMO COc1cccc(C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)c1 ZINC000519160599 1025545527 /nfs/dbraw/zinc/54/55/27/1025545527.db2.gz QKUFIAQHIQSOKS-UHFFFAOYSA-N 1 1 344.411 4.023 20 5 EIBDMO Cc1ccc(C[N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)o1 ZINC000506775747 1025703575 /nfs/dbraw/zinc/70/35/75/1025703575.db2.gz JPECHLJZGJSRQA-UHFFFAOYSA-N 1 1 326.352 4.388 20 5 EIBDMO Cc1ccc(C[N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)o1 ZINC000506775747 1025703607 /nfs/dbraw/zinc/70/36/07/1025703607.db2.gz JPECHLJZGJSRQA-UHFFFAOYSA-N 1 1 326.352 4.388 20 5 EIBDMO CCC[C@H]([NH2+]CCc1ccc2cn[nH]c2c1)c1cccc([N+](=O)[O-])c1 ZINC000585765595 1025829132 /nfs/dbraw/zinc/82/91/32/1025829132.db2.gz YBGDXOHTZLKOMJ-SFHVURJKSA-N 1 1 338.411 4.145 20 5 EIBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@H]1CCCOC1 ZINC000119754166 1026053738 /nfs/dbraw/zinc/05/37/38/1026053738.db2.gz XINBKQBFZWPFAA-CQSZACIVSA-N 1 1 346.452 4.182 20 5 EIBDMO Cc1cccnc1[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])C(C)(C)C ZINC000934285994 1026157773 /nfs/dbraw/zinc/15/77/73/1026157773.db2.gz CIVQZZBKPNSRBG-KRWDZBQOSA-N 1 1 331.391 4.314 20 5 EIBDMO CC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCOC(C)(C)C1 ZINC000519569816 1026373857 /nfs/dbraw/zinc/37/38/57/1026373857.db2.gz WPPIZPLEQADCMG-CQSZACIVSA-N 1 1 326.824 4.028 20 5 EIBDMO COC[C@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000279733771 1026629414 /nfs/dbraw/zinc/62/94/14/1026629414.db2.gz NVPAARRNJNPJBG-WBMJQRKESA-N 1 1 334.803 4.287 20 5 EIBDMO COc1ccc([C@H]2CC[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])C2)cc1 ZINC000512339357 1026738795 /nfs/dbraw/zinc/73/87/95/1026738795.db2.gz UMSLFHLANMFLBP-JXTAAOLFSA-N 1 1 338.407 4.106 20 5 EIBDMO CC[C@@H]1C[C@]1([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1cccc(C)c1 ZINC000500507081 1026805186 /nfs/dbraw/zinc/80/51/86/1026805186.db2.gz HIROHHCRWBJJAB-DNVCBOLYSA-N 1 1 328.387 4.457 20 5 EIBDMO COc1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc(OC)c1 ZINC000479582463 1026844141 /nfs/dbraw/zinc/84/41/41/1026844141.db2.gz YEDDRZKITTXSCK-UHFFFAOYSA-N 1 1 344.411 4.023 20 5 EIBDMO CO[C@@]1(C)CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000475547763 1027583594 /nfs/dbraw/zinc/58/35/94/1027583594.db2.gz IFGDFZSXCAAOKO-IBGZPJMESA-N 1 1 344.411 4.246 20 5 EIBDMO Cn1cc(C[N@@H+](C)[C@H]2CCC(C)(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000475545294 1027596425 /nfs/dbraw/zinc/59/64/25/1027596425.db2.gz BCRKQRQEQNJEMZ-KRWDZBQOSA-N 1 1 342.443 4.006 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+]([C@H]1CCc3cc(Cl)ccc31)CC2 ZINC001167646595 1027827437 /nfs/dbraw/zinc/82/74/37/1027827437.db2.gz FWGBJDYECPEUTF-SFHVURJKSA-N 1 1 328.799 4.294 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+]([C@H]1CCc3cc(Cl)ccc31)CC2 ZINC001167646595 1027827443 /nfs/dbraw/zinc/82/74/43/1027827443.db2.gz FWGBJDYECPEUTF-SFHVURJKSA-N 1 1 328.799 4.294 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H](C)c1cc(C)ccc1C ZINC000523439211 1028114880 /nfs/dbraw/zinc/11/48/80/1028114880.db2.gz OCSODBGZFMMWEG-HNNXBMFYSA-N 1 1 328.412 4.413 20 5 EIBDMO CCC(CC)[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C1CC1 ZINC000536363438 1028163796 /nfs/dbraw/zinc/16/37/96/1028163796.db2.gz OKIBPESOTBQYDX-UHFFFAOYSA-N 1 1 329.400 4.403 20 5 EIBDMO COc1ccc(C[N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)cc1[N+](=O)[O-] ZINC000523582852 1028249244 /nfs/dbraw/zinc/24/92/44/1028249244.db2.gz JMPQUSCATGYLNM-HNNXBMFYSA-N 1 1 346.814 4.246 20 5 EIBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H](C)c1cccc(OC)c1 ZINC000523702141 1028323961 /nfs/dbraw/zinc/32/39/61/1028323961.db2.gz XMZOOZKGFFIVLY-OAHLLOKOSA-N 1 1 328.412 4.229 20 5 EIBDMO C[C@@H](c1ccc(OC(F)F)cc1)[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536005126 1028612195 /nfs/dbraw/zinc/61/21/95/1028612195.db2.gz YJDFTWFWHBNCQK-LBPRGKRZSA-N 1 1 348.349 4.316 20 5 EIBDMO C[C@@H](c1ccc(OC(F)F)cc1)[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536005126 1028612211 /nfs/dbraw/zinc/61/22/11/1028612211.db2.gz YJDFTWFWHBNCQK-LBPRGKRZSA-N 1 1 348.349 4.316 20 5 EIBDMO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000583432779 1028725496 /nfs/dbraw/zinc/72/54/96/1028725496.db2.gz ALLYRTWKZXOUCO-KRWDZBQOSA-N 1 1 344.411 4.195 20 5 EIBDMO CC(C)c1ccc(C[N@@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000584323636 1029736406 /nfs/dbraw/zinc/73/64/06/1029736406.db2.gz XVTBHMZLYUZJKU-RTBURBONSA-N 1 1 344.455 4.252 20 5 EIBDMO CC(C)c1ccc(C[N@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000584323636 1029736412 /nfs/dbraw/zinc/73/64/12/1029736412.db2.gz XVTBHMZLYUZJKU-RTBURBONSA-N 1 1 344.455 4.252 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1COc3ccc(Cl)cc31)CCC2 ZINC000447583422 1030182278 /nfs/dbraw/zinc/18/22/78/1030182278.db2.gz BKFHWZOWKSZZPQ-IAGOWNOFSA-N 1 1 344.798 4.349 20 5 EIBDMO CC(=O)c1ccc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000451543166 1030563915 /nfs/dbraw/zinc/56/39/15/1030563915.db2.gz BCLCLSXKXLZAQX-LJQANCHMSA-N 1 1 338.407 4.177 20 5 EIBDMO CC(=O)c1ccc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000451543165 1030564625 /nfs/dbraw/zinc/56/46/25/1030564625.db2.gz BCLCLSXKXLZAQX-IBGZPJMESA-N 1 1 338.407 4.177 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@H]2CCC2CCCCC2)cc1 ZINC001168174910 1030666954 /nfs/dbraw/zinc/66/69/54/1030666954.db2.gz JXDWLAPBXKLFOY-ICSRJNTNSA-N 1 1 346.471 4.453 20 5 EIBDMO C[C@H](C1CC1)[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000170909019 1031057154 /nfs/dbraw/zinc/05/71/54/1031057154.db2.gz DCQGOAYQENPZQK-CYBMUJFWSA-N 1 1 341.411 4.055 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2nc(C[NH2+][C@@H](c3ccccc3)C3CC3)co2)cc1 ZINC000179690824 1031264272 /nfs/dbraw/zinc/26/42/72/1031264272.db2.gz YVPDHABKPFLYRY-IBGZPJMESA-N 1 1 349.390 4.491 20 5 EIBDMO C[C@H]([NH2+][C@H]1CCc2cc(F)c(F)c(F)c21)c1ccccc1[N+](=O)[O-] ZINC000449200942 1031542595 /nfs/dbraw/zinc/54/25/95/1031542595.db2.gz FXDFUJZFVQBXDB-ZANVPECISA-N 1 1 336.313 4.350 20 5 EIBDMO CCc1ccc([C@H]([NH2+]CCC(C)(F)F)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453227257 1031746232 /nfs/dbraw/zinc/74/62/32/1031746232.db2.gz YEHRMHSHUFTBSH-MRXNPFEDSA-N 1 1 338.354 4.475 20 5 EIBDMO CCO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H]1C ZINC000449504079 1031811675 /nfs/dbraw/zinc/81/16/75/1031811675.db2.gz YHONJTLLMREVCT-RDTXWAMCSA-N 1 1 344.411 4.102 20 5 EIBDMO COC[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000449775645 1032000287 /nfs/dbraw/zinc/00/02/87/1032000287.db2.gz MZMQIDRGELOSHH-OAHLLOKOSA-N 1 1 344.411 4.103 20 5 EIBDMO COC[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000449782376 1032006044 /nfs/dbraw/zinc/00/60/44/1032006044.db2.gz ZGRKSCQEMSIIIU-OAHLLOKOSA-N 1 1 344.411 4.103 20 5 EIBDMO CC(C)(C)[C@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000542320590 1033841408 /nfs/dbraw/zinc/84/14/08/1033841408.db2.gz QYMKUINNSYEQGW-HNNXBMFYSA-N 1 1 343.427 4.160 20 5 EIBDMO Cn1c[nH+]c2cc(N[C@@H]3CC(C)(C)c4ccc([N+](=O)[O-])cc43)ccc21 ZINC000433226710 1034062304 /nfs/dbraw/zinc/06/23/04/1034062304.db2.gz OECVPJMEENBNBF-QGZVFWFLSA-N 1 1 336.395 4.316 20 5 EIBDMO CC1(C)C[C@@H]([NH2+][C@H]2COc3ccc(F)cc32)c2cc([N+](=O)[O-])ccc21 ZINC000433231544 1034080756 /nfs/dbraw/zinc/08/07/56/1034080756.db2.gz KKMGGEQTSAMAEA-SJORKVTESA-N 1 1 342.370 4.180 20 5 EIBDMO CSCc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000512989127 1034284592 /nfs/dbraw/zinc/28/45/92/1034284592.db2.gz PEHZVCAPLKUWCY-UHFFFAOYSA-N 1 1 336.844 4.401 20 5 EIBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(Br)cc1 ZINC000404222511 1035099788 /nfs/dbraw/zinc/09/97/88/1035099788.db2.gz WIRFYEITDYYCFO-UHFFFAOYSA-N 1 1 349.228 4.032 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)c1ccccc1SC ZINC000501490179 1035452090 /nfs/dbraw/zinc/45/20/90/1035452090.db2.gz JBRJHOJECWUOQP-GFCCVEGCSA-N 1 1 332.425 4.176 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H]1CSCc2ccccc21 ZINC000595011224 1035504393 /nfs/dbraw/zinc/50/43/93/1035504393.db2.gz CKMXIJAVWKKARP-PXAZEXFGSA-N 1 1 344.436 4.242 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CSc2ccccc21 ZINC000595009910 1035504473 /nfs/dbraw/zinc/50/44/73/1035504473.db2.gz UJFUXUGFVJEIQM-XHDPSFHLSA-N 1 1 330.409 4.101 20 5 EIBDMO COc1ccccc1[C@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595003303 1035527147 /nfs/dbraw/zinc/52/71/47/1035527147.db2.gz GMBCBCHPVMJHNM-STQMWFEESA-N 1 1 330.384 4.024 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](c1ncccc1C)C(C)C ZINC000595007720 1035529769 /nfs/dbraw/zinc/52/97/69/1035529769.db2.gz IXMKGUQPHQNQCL-KBXCAEBGSA-N 1 1 343.427 4.355 20 5 EIBDMO Cc1noc(C[N@@H+](CCc2cccc(F)c2)C2CCCC2)c1[N+](=O)[O-] ZINC000595340128 1035634900 /nfs/dbraw/zinc/63/49/00/1035634900.db2.gz VZIGKEUHPATOKM-UHFFFAOYSA-N 1 1 347.390 4.018 20 5 EIBDMO CCCc1ccc([C@H]([NH2+]Cc2onc(C)c2[N+](=O)[O-])C(C)C)cc1 ZINC000595351479 1035667197 /nfs/dbraw/zinc/66/71/97/1035667197.db2.gz SQRRIKKWYQCNFS-QGZVFWFLSA-N 1 1 331.416 4.331 20 5 EIBDMO Cc1noc(C[NH2+]C2(c3ccc(Cl)cc3)CCCCC2)c1[N+](=O)[O-] ZINC000595366072 1035668555 /nfs/dbraw/zinc/66/85/55/1035668555.db2.gz SAXLXOWUBPUBFP-UHFFFAOYSA-N 1 1 349.818 4.494 20 5 EIBDMO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595412888 1035674078 /nfs/dbraw/zinc/67/40/78/1035674078.db2.gz NYZAWRWLXRXOFE-MRXNPFEDSA-N 1 1 332.375 4.374 20 5 EIBDMO Cc1noc(C[NH2+][C@H](CC2CCCC2)c2ccccc2)c1[N+](=O)[O-] ZINC000595421093 1035676866 /nfs/dbraw/zinc/67/68/66/1035676866.db2.gz RGJSDMAWRHGVIN-MRXNPFEDSA-N 1 1 329.400 4.302 20 5 EIBDMO Cc1noc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)c1[N+](=O)[O-] ZINC000595424397 1035677263 /nfs/dbraw/zinc/67/72/63/1035677263.db2.gz MDELOOKHJBMKFV-XXLQHYSLSA-N 1 1 335.791 4.032 20 5 EIBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000595474712 1035685657 /nfs/dbraw/zinc/68/56/57/1035685657.db2.gz DLCNRKZXZZNQPT-CQSZACIVSA-N 1 1 346.324 4.288 20 5 EIBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000595474712 1035685668 /nfs/dbraw/zinc/68/56/68/1035685668.db2.gz DLCNRKZXZZNQPT-CQSZACIVSA-N 1 1 346.324 4.288 20 5 EIBDMO Cc1ncsc1C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491058184 1035798610 /nfs/dbraw/zinc/79/86/10/1035798610.db2.gz XHCPNJZJJWLBHB-GOSISDBHSA-N 1 1 339.420 4.239 20 5 EIBDMO COc1cc(C[N@H+]2CCCCC[C@@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000485570394 1036029833 /nfs/dbraw/zinc/02/98/33/1036029833.db2.gz PLKYCOXUTSFHRP-OAHLLOKOSA-N 1 1 330.384 4.314 20 5 EIBDMO COCc1csc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000597136944 1036117400 /nfs/dbraw/zinc/11/74/00/1036117400.db2.gz CQYFLCXWZDQTDM-MRXNPFEDSA-N 1 1 346.452 4.182 20 5 EIBDMO COc1cc(C[N@H+](C)[C@@H](C)c2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000485769196 1036252699 /nfs/dbraw/zinc/25/26/99/1036252699.db2.gz GHOMGPIRDLXXEL-NSHDSACASA-N 1 1 336.338 4.075 20 5 EIBDMO COc1cc(C[N@@H+](C)[C@@H](C)c2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000485769196 1036252715 /nfs/dbraw/zinc/25/27/15/1036252715.db2.gz GHOMGPIRDLXXEL-NSHDSACASA-N 1 1 336.338 4.075 20 5 EIBDMO C[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc2ncsc2c1 ZINC000485803184 1036284438 /nfs/dbraw/zinc/28/44/38/1036284438.db2.gz NPMTXLKNENHDTP-SNVBAGLBSA-N 1 1 331.372 4.194 20 5 EIBDMO Cn1cc(C[N@H+]2CCC[C@@H]2C(C)(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000513759905 1036822069 /nfs/dbraw/zinc/82/20/69/1036822069.db2.gz HRQWOBBWMVVKFJ-QGZVFWFLSA-N 1 1 342.443 4.006 20 5 EIBDMO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000603662472 1036929960 /nfs/dbraw/zinc/92/99/60/1036929960.db2.gz CVECSEZXDGLEQF-AWEZNQCLSA-N 1 1 340.379 4.413 20 5 EIBDMO Cc1c(C[NH2+]Cc2cc(Cl)ccc2Cl)cccc1[N+](=O)[O-] ZINC000231885662 1037010856 /nfs/dbraw/zinc/01/08/56/1037010856.db2.gz SSMVZKLDXGKSFJ-UHFFFAOYSA-N 1 1 325.195 4.500 20 5 EIBDMO COc1ccc(C[N@H+]2CC=C(c3ccc(F)cc3)CC2)cc1[N+](=O)[O-] ZINC000603838885 1037022257 /nfs/dbraw/zinc/02/22/57/1037022257.db2.gz QYRWSZJDVNDVNA-UHFFFAOYSA-N 1 1 342.370 4.032 20 5 EIBDMO COc1ccc(C[N@@H+]2CC=C(c3ccc(F)cc3)CC2)cc1[N+](=O)[O-] ZINC000603838885 1037022272 /nfs/dbraw/zinc/02/22/72/1037022272.db2.gz QYRWSZJDVNDVNA-UHFFFAOYSA-N 1 1 342.370 4.032 20 5 EIBDMO COc1cccc([C@@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000603836877 1037032160 /nfs/dbraw/zinc/03/21/60/1037032160.db2.gz XUKYVEWTMFNHKL-IBGZPJMESA-N 1 1 326.396 4.249 20 5 EIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H]1c1cccc(Cl)c1 ZINC000603854138 1037047018 /nfs/dbraw/zinc/04/70/18/1037047018.db2.gz SDOYCOONNBOTPY-INIZCTEOSA-N 1 1 346.814 4.464 20 5 EIBDMO CC1(C)CCC(C)(C)[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000599537598 1037066456 /nfs/dbraw/zinc/06/64/56/1037066456.db2.gz GEQWVQFTLRZAQZ-UHFFFAOYSA-N 1 1 344.415 4.045 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H](C)C2CC2)cc1 ZINC000057601237 1037133532 /nfs/dbraw/zinc/13/35/32/1037133532.db2.gz MEMPMRJQRVMIMP-OAHLLOKOSA-N 1 1 340.423 4.404 20 5 EIBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@@H]2c2ccccc2)cc1 ZINC000604012595 1037146997 /nfs/dbraw/zinc/14/69/97/1037146997.db2.gz TZEQSWFGZPWQSG-LJQANCHMSA-N 1 1 326.396 4.201 20 5 EIBDMO O=C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000590967189 1037214104 /nfs/dbraw/zinc/21/41/04/1037214104.db2.gz FHJRUOOHFFSFBX-GASCZTMLSA-N 1 1 342.420 4.019 20 5 EIBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H]1CCCO[C@H]1c1ccccc1 ZINC000604520687 1037402728 /nfs/dbraw/zinc/40/27/28/1037402728.db2.gz CBVIPPNTAUSFOJ-QUCCMNQESA-N 1 1 340.423 4.195 20 5 EIBDMO COc1cccc(C[N@H+](Cc2ccccc2[N+](=O)[O-])CC(C)C)c1 ZINC000604493129 1037408000 /nfs/dbraw/zinc/40/80/00/1037408000.db2.gz QWYDEQYEMSFLQL-UHFFFAOYSA-N 1 1 328.412 4.262 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@]1(c2ccc(Cl)cc2)C[C@@H]1C ZINC000503403014 1037738837 /nfs/dbraw/zinc/73/88/37/1037738837.db2.gz CQTTXIPVPUMKNZ-KPZWWZAWSA-N 1 1 346.814 4.282 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)C[C@@H]1OCCc2ccccc21 ZINC000489150035 1037883210 /nfs/dbraw/zinc/88/32/10/1037883210.db2.gz AJPDUKOAJQBGSI-YWZLYKJASA-N 1 1 340.423 4.210 20 5 EIBDMO Cc1ccnc([C@@H]2CC[N@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)c1 ZINC000594004974 1038186826 /nfs/dbraw/zinc/18/68/26/1038186826.db2.gz REHVRUYTECAMTD-JKSUJKDBSA-N 1 1 325.412 4.157 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC000490056591 1038323802 /nfs/dbraw/zinc/32/38/02/1038323802.db2.gz PXYXSTSUQVJDED-RDJZCZTQSA-N 1 1 325.412 4.232 20 5 EIBDMO COc1cc(C[N@@H+]2CC[C@@H](C)C[C@@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000490067085 1038329783 /nfs/dbraw/zinc/32/97/83/1038329783.db2.gz LUALNFKOGBVNPF-CZUORRHYSA-N 1 1 330.384 4.170 20 5 EIBDMO COc1cc(C[N@H+]2CC[C@@H](C)C[C@@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000490067085 1038329792 /nfs/dbraw/zinc/32/97/92/1038329792.db2.gz LUALNFKOGBVNPF-CZUORRHYSA-N 1 1 330.384 4.170 20 5 EIBDMO C[C@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1ccc([N+](=O)[O-])cc1 ZINC000594719294 1038392744 /nfs/dbraw/zinc/39/27/44/1038392744.db2.gz BRWWHTYJNFEECO-LBPRGKRZSA-N 1 1 330.359 4.126 20 5 EIBDMO CC(C)([NH2+]Cc1cccc(OC2CC2)c1F)c1ccccc1[N+](=O)[O-] ZINC000594943509 1038495277 /nfs/dbraw/zinc/49/52/77/1038495277.db2.gz KDHDTSQXLGMYNZ-UHFFFAOYSA-N 1 1 344.386 4.300 20 5 EIBDMO COc1cccc([C@@H]2C[C@@H](C)C[N@@H+]2Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC001168424153 1038623040 /nfs/dbraw/zinc/62/30/40/1038623040.db2.gz UOUTWLLLPJGBOV-YJYMSZOUSA-N 1 1 344.386 4.326 20 5 EIBDMO COc1cccc([C@@H]2C[C@@H](C)C[N@H+]2Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC001168424153 1038623051 /nfs/dbraw/zinc/62/30/51/1038623051.db2.gz UOUTWLLLPJGBOV-YJYMSZOUSA-N 1 1 344.386 4.326 20 5 EIBDMO COc1cccc([C@H]2C[C@H](C)C[N@@H+]2Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC001168424152 1038623321 /nfs/dbraw/zinc/62/33/21/1038623321.db2.gz UOUTWLLLPJGBOV-ORAYPTAESA-N 1 1 344.386 4.326 20 5 EIBDMO COc1cccc([C@H]2C[C@H](C)C[N@H+]2Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC001168424152 1038623329 /nfs/dbraw/zinc/62/33/29/1038623329.db2.gz UOUTWLLLPJGBOV-ORAYPTAESA-N 1 1 344.386 4.326 20 5 EIBDMO CC(C)[N@H+]1CCC[C@H](CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000063738875 1038804526 /nfs/dbraw/zinc/80/45/26/1038804526.db2.gz NEFQKAWZYURGKK-GFCCVEGCSA-N 1 1 345.365 4.146 20 5 EIBDMO CC[C@@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1cccc([N+](=O)[O-])c1 ZINC000539063004 1038807342 /nfs/dbraw/zinc/80/73/42/1038807342.db2.gz NPKIJPKWRPEXQK-HZPDHXFCSA-N 1 1 332.787 4.423 20 5 EIBDMO Cc1cc(N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c(F)cc1[N+](=O)[O-] ZINC000461935716 1038838462 /nfs/dbraw/zinc/83/84/62/1038838462.db2.gz KQBJPGONPVGCEV-KBPBESRZSA-N 1 1 335.423 4.107 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]Cc2ccc(Cl)o2)o1 ZINC000608835452 1038922961 /nfs/dbraw/zinc/92/29/61/1038922961.db2.gz GZHLSMLGGGCXNC-UHFFFAOYSA-N 1 1 332.743 4.391 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CC(c2nc3ccccc3s2)C1 ZINC000534215661 1039220285 /nfs/dbraw/zinc/22/02/85/1039220285.db2.gz HPUNKCQZMWTUOE-LBPRGKRZSA-N 1 1 339.420 4.365 20 5 EIBDMO COC1CCC([N@@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000552242290 1039308810 /nfs/dbraw/zinc/30/88/10/1039308810.db2.gz IIYQZANCAAETIQ-UHFFFAOYSA-N 1 1 344.411 4.244 20 5 EIBDMO CC[C@@H]1CCCCC[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000537635906 1039364391 /nfs/dbraw/zinc/36/43/91/1039364391.db2.gz FKCZTCWDVCSZEE-QGZVFWFLSA-N 1 1 342.443 4.150 20 5 EIBDMO CCC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1CCCc2cccnc21 ZINC000481416051 1039403573 /nfs/dbraw/zinc/40/35/73/1039403573.db2.gz GYKNRAAWCKWUST-GOSISDBHSA-N 1 1 325.412 4.279 20 5 EIBDMO C[N@@H+](CCCCc1ccccc1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000434836041 1039880860 /nfs/dbraw/zinc/88/08/60/1039880860.db2.gz JGEYTCBKFFDYFD-UHFFFAOYSA-N 1 1 339.395 4.191 20 5 EIBDMO CC(C)O[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000593054671 1040120509 /nfs/dbraw/zinc/12/05/09/1040120509.db2.gz YVNNRRSIIJJKTP-AWEZNQCLSA-N 1 1 346.349 4.003 20 5 EIBDMO CC(C)O[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000593054671 1040120519 /nfs/dbraw/zinc/12/05/19/1040120519.db2.gz YVNNRRSIIJJKTP-AWEZNQCLSA-N 1 1 346.349 4.003 20 5 EIBDMO CCC[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)CC1CC1 ZINC000435233952 1040210797 /nfs/dbraw/zinc/21/07/97/1040210797.db2.gz YHNUGOUZAPWDEQ-UHFFFAOYSA-N 1 1 331.441 4.340 20 5 EIBDMO C[C@@H]1[C@H](C(F)(F)F)CCC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000482517581 1040314440 /nfs/dbraw/zinc/31/44/40/1040314440.db2.gz ZSVQUNJOXIGPFU-OWOXYTMYSA-N 1 1 328.334 4.271 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@@H]3C3CCC3)co2)cc1 ZINC000089892801 1040515266 /nfs/dbraw/zinc/51/52/66/1040515266.db2.gz MRNHJYIRLMFUPF-QGZVFWFLSA-N 1 1 327.384 4.014 20 5 EIBDMO CSC[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000539849635 1040838474 /nfs/dbraw/zinc/83/84/74/1040838474.db2.gz IGMZMGCTCUWUBM-HNNXBMFYSA-N 1 1 332.425 4.182 20 5 EIBDMO Cc1c([C@@H](C)[NH2+]Cc2cccc(OC(C)(C)C)n2)cccc1[N+](=O)[O-] ZINC000537940949 1040907446 /nfs/dbraw/zinc/90/74/46/1040907446.db2.gz CGDAYXKYMZXRHE-CQSZACIVSA-N 1 1 343.427 4.326 20 5 EIBDMO C[C@H](NC[C@H]1CCC[N@H+]1C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000436286760 1041037196 /nfs/dbraw/zinc/03/71/96/1041037196.db2.gz BBWJVWFBDSZYNO-HNAYVOBHSA-N 1 1 331.460 4.043 20 5 EIBDMO CC(C)[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H]1CCOC1 ZINC000462869228 1041048779 /nfs/dbraw/zinc/04/87/79/1041048779.db2.gz FHSXFSSYISPDSG-AWEZNQCLSA-N 1 1 346.452 4.323 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1COc2ccc(Cl)cc21 ZINC000540161671 1041193501 /nfs/dbraw/zinc/19/35/01/1041193501.db2.gz YXAJDNMIFVKSQP-BZNIZROVSA-N 1 1 332.787 4.341 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1COc2ccc(Cl)cc21 ZINC000540161673 1041196369 /nfs/dbraw/zinc/19/63/69/1041196369.db2.gz YXAJDNMIFVKSQP-ZBEGNZNMSA-N 1 1 332.787 4.341 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](COc2ccccc2)C1 ZINC000505875178 1041457846 /nfs/dbraw/zinc/45/78/46/1041457846.db2.gz STBZYPJRBOGAES-DLBZAZTESA-N 1 1 340.423 4.365 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](COc2ccccc2)C1 ZINC000505875180 1041458109 /nfs/dbraw/zinc/45/81/09/1041458109.db2.gz STBZYPJRBOGAES-IRXDYDNUSA-N 1 1 340.423 4.365 20 5 EIBDMO CC(C)COC[C@@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1ccco1 ZINC000540596658 1041552354 /nfs/dbraw/zinc/55/23/54/1041552354.db2.gz UTDWUKIQKBMNFL-CTEOGUNLSA-N 1 1 344.411 4.205 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000463426530 1041562533 /nfs/dbraw/zinc/56/25/33/1041562533.db2.gz YZFZTOGVEGRXEF-CQSZACIVSA-N 1 1 338.407 4.217 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000463426530 1041562540 /nfs/dbraw/zinc/56/25/40/1041562540.db2.gz YZFZTOGVEGRXEF-CQSZACIVSA-N 1 1 338.407 4.217 20 5 EIBDMO CCC[C@H]([NH2+][C@@H](c1ccccc1F)[C@@H](C)O)c1cccc([N+](=O)[O-])c1 ZINC000517035865 1041844853 /nfs/dbraw/zinc/84/48/53/1041844853.db2.gz RJYOVNOQTVDPRV-ZNZDAUKMSA-N 1 1 346.402 4.287 20 5 EIBDMO C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000506178223 1042059944 /nfs/dbraw/zinc/05/99/44/1042059944.db2.gz IRDPFZZAMHZLDR-RDTXWAMCSA-N 1 1 342.443 4.006 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C1(c2ccc(F)cc2F)CCC1 ZINC000541775492 1042099658 /nfs/dbraw/zinc/09/96/58/1042099658.db2.gz RKUOVLXDEVSPOA-UHFFFAOYSA-N 1 1 332.350 4.350 20 5 EIBDMO C[C@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccco2)C1 ZINC000464850631 1042197066 /nfs/dbraw/zinc/19/70/66/1042197066.db2.gz IMVDIPQBGWXDER-WMLDXEAASA-N 1 1 330.384 4.040 20 5 EIBDMO CCCc1nc(C)c(C[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)o1 ZINC000492259537 1042591150 /nfs/dbraw/zinc/59/11/50/1042591150.db2.gz PSUUUUXMUQVVBH-UHFFFAOYSA-N 1 1 331.416 4.257 20 5 EIBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cccc(SCC)c1 ZINC000492297127 1042604535 /nfs/dbraw/zinc/60/45/35/1042604535.db2.gz UBNVCUARUCTVNT-UHFFFAOYSA-N 1 1 346.452 4.395 20 5 EIBDMO CCOc1cc(C[N@@H+](C)[C@H]2CCc3ccccc32)ccc1[N+](=O)[O-] ZINC000492460713 1042664688 /nfs/dbraw/zinc/66/46/88/1042664688.db2.gz IWANTWILZUJNNW-KRWDZBQOSA-N 1 1 326.396 4.113 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)Cc1nc2ccccc2o1 ZINC000492937021 1042769897 /nfs/dbraw/zinc/76/98/97/1042769897.db2.gz PLXRNAQMYKKKFB-ZDUSSCGKSA-N 1 1 325.368 4.237 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)Cc1nc2ccccc2o1 ZINC000492937021 1042769903 /nfs/dbraw/zinc/76/99/03/1042769903.db2.gz PLXRNAQMYKKKFB-ZDUSSCGKSA-N 1 1 325.368 4.237 20 5 EIBDMO Cc1c(C[NH2+][C@H](c2ccccc2)c2ccccn2)cccc1[N+](=O)[O-] ZINC000076581135 1042877578 /nfs/dbraw/zinc/87/75/78/1042877578.db2.gz GZYZWDVNOKHAJP-HXUWFJFHSA-N 1 1 333.391 4.177 20 5 EIBDMO C[C@@H]1CCc2nc(C[NH2+]C(C)(C)c3ccc([N+](=O)[O-])cc3)sc2C1 ZINC000152917020 1043019888 /nfs/dbraw/zinc/01/98/88/1043019888.db2.gz PYEVHNYMCYAEOD-GFCCVEGCSA-N 1 1 345.468 4.201 20 5 EIBDMO COc1cc(C[N@@H+]2CCC[C@@H]2c2cccs2)c([N+](=O)[O-])cc1OC ZINC000162697672 1043151846 /nfs/dbraw/zinc/15/18/46/1043151846.db2.gz VPMDOAFMXBWPKS-CYBMUJFWSA-N 1 1 348.424 4.011 20 5 EIBDMO COc1cc(C[N@H+]2CCC[C@@H]2c2cccs2)c([N+](=O)[O-])cc1OC ZINC000162697672 1043151859 /nfs/dbraw/zinc/15/18/59/1043151859.db2.gz VPMDOAFMXBWPKS-CYBMUJFWSA-N 1 1 348.424 4.011 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3nccs3)s2)cc1 ZINC000171050356 1043266443 /nfs/dbraw/zinc/26/64/43/1043266443.db2.gz YDCXKUJLSJSZJS-UHFFFAOYSA-N 1 1 331.422 4.070 20 5 EIBDMO Cc1nc(C)c([C@H](C)[N@@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])s1 ZINC000255417591 1043469573 /nfs/dbraw/zinc/46/95/73/1043469573.db2.gz LGNGVWOBHYHUGD-JWJUJFCLSA-N 1 1 331.441 4.374 20 5 EIBDMO Cc1cc(C)cc([C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)c2cccnc2)c1 ZINC000731453222 1043761051 /nfs/dbraw/zinc/76/10/51/1043761051.db2.gz YDQLZVIJXYJKDQ-NRFANRHFSA-N 1 1 347.418 4.486 20 5 EIBDMO Cc1ccc(-c2cc(C[NH2+][C@H](C)c3cccc([N+](=O)[O-])c3)on2)cc1 ZINC000173359656 1043916645 /nfs/dbraw/zinc/91/66/45/1043916645.db2.gz XXUZYPVPLGDNRN-CQSZACIVSA-N 1 1 337.379 4.409 20 5 EIBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[C@H](C)C1 ZINC000443063645 1043984015 /nfs/dbraw/zinc/98/40/15/1043984015.db2.gz DLCYPOCNFNAOAV-CJNGLKHVSA-N 1 1 346.452 4.323 20 5 EIBDMO COc1ccc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)cc1F ZINC000237249321 1044306613 /nfs/dbraw/zinc/30/66/13/1044306613.db2.gz BKZGOIDUDMLBOV-JTQLQIEISA-N 1 1 338.766 4.247 20 5 EIBDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000766208894 1044485554 /nfs/dbraw/zinc/48/55/54/1044485554.db2.gz ADKNROIVSRZODY-LBPRGKRZSA-N 1 1 334.803 4.017 20 5 EIBDMO CCC[C@H]([NH2+]Cc1nccn1CC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000164808753 1044510468 /nfs/dbraw/zinc/51/04/68/1044510468.db2.gz CBIUAJTVJQTLNG-KRWDZBQOSA-N 1 1 330.432 4.078 20 5 EIBDMO COCC[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)[C@H](C)c1ccccc1 ZINC000735490874 1044823633 /nfs/dbraw/zinc/82/36/33/1044823633.db2.gz TUZSHCHWZQBRJK-CQSZACIVSA-N 1 1 348.830 4.458 20 5 EIBDMO COCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)[C@H](C)c1ccccc1 ZINC000735490874 1044823635 /nfs/dbraw/zinc/82/36/35/1044823635.db2.gz TUZSHCHWZQBRJK-CQSZACIVSA-N 1 1 348.830 4.458 20 5 EIBDMO C[C@H]1SCC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H]1C ZINC000093499630 1044840218 /nfs/dbraw/zinc/84/02/18/1044840218.db2.gz VAGYNJWDYAGNKU-VXGBXAGGSA-N 1 1 349.481 4.044 20 5 EIBDMO C[C@H]1SCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H]1C ZINC000093499630 1044840222 /nfs/dbraw/zinc/84/02/22/1044840222.db2.gz VAGYNJWDYAGNKU-VXGBXAGGSA-N 1 1 349.481 4.044 20 5 EIBDMO CCc1ccc(C(C)(C)[NH2+]Cc2c(F)cc([N+](=O)[O-])cc2F)cc1 ZINC000509022008 1044937605 /nfs/dbraw/zinc/93/76/05/1044937605.db2.gz JORLMULPXNHEDF-UHFFFAOYSA-N 1 1 334.366 4.460 20 5 EIBDMO C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000736627155 1044961046 /nfs/dbraw/zinc/96/10/46/1044961046.db2.gz CLFIXOWMOIREBE-OCCSQVGLSA-N 1 1 332.350 4.251 20 5 EIBDMO Cc1nn(C[N@H+]2CCC[C@H](C)[C@H]2c2ccc(C)cc2)c(C)c1[N+](=O)[O-] ZINC000738284649 1045047677 /nfs/dbraw/zinc/04/76/77/1045047677.db2.gz MXGUXHQZFHGNBE-KSSFIOAISA-N 1 1 342.443 4.147 20 5 EIBDMO Cc1nn(C[N@@H+]2CCC[C@H](C)[C@H]2c2ccc(C)cc2)c(C)c1[N+](=O)[O-] ZINC000738284649 1045047685 /nfs/dbraw/zinc/04/76/85/1045047685.db2.gz MXGUXHQZFHGNBE-KSSFIOAISA-N 1 1 342.443 4.147 20 5 EIBDMO CC[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@H]1CCOC1 ZINC000611256610 1045269677 /nfs/dbraw/zinc/26/96/77/1045269677.db2.gz JPRQUJMDDPAZGT-CQSZACIVSA-N 1 1 346.452 4.182 20 5 EIBDMO C[N@@H+](CCOC(C)(C)C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000611274767 1045272182 /nfs/dbraw/zinc/27/21/82/1045272182.db2.gz ZFELRIDVCTURLV-UHFFFAOYSA-N 1 1 332.400 4.102 20 5 EIBDMO CCOC(=O)CC[C@@H]1CCC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000611516768 1045320819 /nfs/dbraw/zinc/32/08/19/1045320819.db2.gz WDUSORJMHCZAKJ-HOTGVXAUSA-N 1 1 348.443 4.020 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+]Cc2nc(-c3ccccc3)c[nH]2)cc1[N+](=O)[O-] ZINC000194354943 1045724644 /nfs/dbraw/zinc/72/46/44/1045724644.db2.gz ZMAVIHKGPDXRTO-AWEZNQCLSA-N 1 1 336.395 4.144 20 5 EIBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2c(c1)COC2 ZINC000768337700 1045791762 /nfs/dbraw/zinc/79/17/62/1045791762.db2.gz LEQVHPAJJNOOMF-UHFFFAOYSA-N 1 1 326.396 4.036 20 5 EIBDMO CO[C@]1(C(F)(F)F)CCC[N@@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000614923784 1045944875 /nfs/dbraw/zinc/94/48/75/1045944875.db2.gz FQEZPOUUSOYVQN-IUODEOHRSA-N 1 1 346.349 4.008 20 5 EIBDMO CO[C@]1(C(F)(F)F)CCC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000614923784 1045944888 /nfs/dbraw/zinc/94/48/88/1045944888.db2.gz FQEZPOUUSOYVQN-IUODEOHRSA-N 1 1 346.349 4.008 20 5 EIBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC001170347165 1046021986 /nfs/dbraw/zinc/02/19/86/1046021986.db2.gz QYRVBLAPXDIHTG-BBRMVZONSA-N 1 1 346.452 4.433 20 5 EIBDMO COc1ccc(C[C@H](C)[N@@H+](C)CCc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC001170348555 1046022490 /nfs/dbraw/zinc/02/24/90/1046022490.db2.gz YKJHQOUBTXTIHN-INIZCTEOSA-N 1 1 342.439 4.017 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@]2(C)[C@H](C1)C2(Cl)Cl ZINC000792911380 1046104657 /nfs/dbraw/zinc/10/46/57/1046104657.db2.gz XBOWPQKWGOMALE-DDTOSNHZSA-N 1 1 329.227 4.172 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@]2(C)[C@@H](C1)C2(Cl)Cl ZINC000792914821 1046106830 /nfs/dbraw/zinc/10/68/30/1046106830.db2.gz XURYUQGBDIBTFZ-HONMWMINSA-N 1 1 329.227 4.172 20 5 EIBDMO CC[N@H+]1CC[C@@H](N(C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000536659977 1046629338 /nfs/dbraw/zinc/62/93/38/1046629338.db2.gz QNQDMKRBRJGWBH-DOTOQJQBSA-N 1 1 333.476 4.023 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](Cc1cccc(-c3ccccn3)c1)CC2 ZINC000536671386 1046654728 /nfs/dbraw/zinc/65/47/28/1046654728.db2.gz GZBUZTNSPUIFEJ-UHFFFAOYSA-N 1 1 345.402 4.215 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1cccc(-c3ccccn3)c1)CC2 ZINC000536671386 1046654734 /nfs/dbraw/zinc/65/47/34/1046654734.db2.gz GZBUZTNSPUIFEJ-UHFFFAOYSA-N 1 1 345.402 4.215 20 5 EIBDMO Cc1c(CO[NH+]=C(N)C23CC4CC(CC(C4)C2)C3)cccc1[N+](=O)[O-] ZINC000917394274 1046861443 /nfs/dbraw/zinc/86/14/43/1046861443.db2.gz GUEXNHADKVYWII-UHFFFAOYSA-N 1 1 343.427 4.118 20 5 EIBDMO Cc1ccccc1[C@H]1CCC[N@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000917484193 1046905052 /nfs/dbraw/zinc/90/50/52/1046905052.db2.gz WTJQYMLTHIJYKQ-GOSISDBHSA-N 1 1 336.395 4.048 20 5 EIBDMO C[N@H+](Cc1cccc2ccccc21)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000917469158 1046909653 /nfs/dbraw/zinc/90/96/53/1046909653.db2.gz BEHKLMJXOJPRTN-UHFFFAOYSA-N 1 1 346.390 4.187 20 5 EIBDMO CC[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C[C@H](O)c1ccc(C)cc1 ZINC000746672756 1046984288 /nfs/dbraw/zinc/98/42/88/1046984288.db2.gz IMFVBIHCYDFEGE-SFHVURJKSA-N 1 1 348.830 4.112 20 5 EIBDMO C[C@@H](NCc1cc([O-])ccc1[N+](=O)[O-])c1csc2ccccc21 ZINC000763429507 1047528590 /nfs/dbraw/zinc/52/85/90/1047528590.db2.gz FNIWTVRHBWYGHJ-LLVKDONJSA-N 1 1 328.393 4.366 20 5 EIBDMO CC[C@@H](c1cccc(OC)c1)[N@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000808761272 1048087763 /nfs/dbraw/zinc/08/77/63/1048087763.db2.gz KNNVIJLUBPJJLT-KRWDZBQOSA-N 1 1 332.375 4.326 20 5 EIBDMO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000808761272 1048087780 /nfs/dbraw/zinc/08/77/80/1048087780.db2.gz KNNVIJLUBPJJLT-KRWDZBQOSA-N 1 1 332.375 4.326 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CCCN(C)Cc1ccco1 ZINC000556884585 1048100487 /nfs/dbraw/zinc/10/04/87/1048100487.db2.gz KCFMYYXPFAGFSS-MRXNPFEDSA-N 1 1 345.443 4.011 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N(C)CCC[N@H+](C)Cc1ccco1 ZINC000556884585 1048100495 /nfs/dbraw/zinc/10/04/95/1048100495.db2.gz KCFMYYXPFAGFSS-MRXNPFEDSA-N 1 1 345.443 4.011 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N(C)CCC[N@@H+](C)Cc1ccco1 ZINC000556884585 1048100506 /nfs/dbraw/zinc/10/05/06/1048100506.db2.gz KCFMYYXPFAGFSS-MRXNPFEDSA-N 1 1 345.443 4.011 20 5 EIBDMO C[C@@H](O)C[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809998358 1048599269 /nfs/dbraw/zinc/59/92/69/1048599269.db2.gz OXNGVRYKYYTNHW-MFKMUULPSA-N 1 1 347.242 4.027 20 5 EIBDMO C[C@@H](O)C[C@@H]1CCCC[N@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809998358 1048599282 /nfs/dbraw/zinc/59/92/82/1048599282.db2.gz OXNGVRYKYYTNHW-MFKMUULPSA-N 1 1 347.242 4.027 20 5 EIBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cnc(Cl)c(F)c1 ZINC000846780929 1048896017 /nfs/dbraw/zinc/89/60/17/1048896017.db2.gz ALVXJUADJNMQKN-UHFFFAOYSA-N 1 1 337.782 4.193 20 5 EIBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cnc(Cl)c(F)c1 ZINC000846780929 1048896020 /nfs/dbraw/zinc/89/60/20/1048896020.db2.gz ALVXJUADJNMQKN-UHFFFAOYSA-N 1 1 337.782 4.193 20 5 EIBDMO C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000609916157 1049395916 /nfs/dbraw/zinc/39/59/16/1049395916.db2.gz BMQUZKWSBIGQRI-OCCSQVGLSA-N 1 1 332.350 4.251 20 5 EIBDMO CCc1nc(C)c([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)s1 ZINC000773033294 1049544639 /nfs/dbraw/zinc/54/46/39/1049544639.db2.gz AKAIAVAHVFBERA-VIFPVBQESA-N 1 1 339.848 4.426 20 5 EIBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccc(Cl)nc1 ZINC000773038598 1049547129 /nfs/dbraw/zinc/54/71/29/1049547129.db2.gz AABAKAROGJIMFC-VIFPVBQESA-N 1 1 326.183 4.147 20 5 EIBDMO Cc1ccc(C[N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)nc1 ZINC000616152023 1049855451 /nfs/dbraw/zinc/85/54/51/1049855451.db2.gz ACQKOGKVYJSZDR-UHFFFAOYSA-N 1 1 337.379 4.190 20 5 EIBDMO Cc1ccc(C[N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)nc1 ZINC000616152023 1049855456 /nfs/dbraw/zinc/85/54/56/1049855456.db2.gz ACQKOGKVYJSZDR-UHFFFAOYSA-N 1 1 337.379 4.190 20 5 EIBDMO C[C@@H]1CC[N@@H+](Cc2c3ccccc3cc3ccccc32)CC[S@@]1=O ZINC000763490241 1050062070 /nfs/dbraw/zinc/06/20/70/1050062070.db2.gz KFRMGTMUXIEJEE-GYCJOSAFSA-N 1 1 337.488 4.336 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCC[C@@H]1c1ccncc1)CC2 ZINC001172915583 1050231940 /nfs/dbraw/zinc/23/19/40/1050231940.db2.gz PERJPAJYUCGKQJ-AZUAARDMSA-N 1 1 337.423 4.074 20 5 EIBDMO C[N@@H+](CCc1cccc(F)c1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172913895 1050232241 /nfs/dbraw/zinc/23/22/41/1050232241.db2.gz VNHXRFBUSVYVJI-LJQANCHMSA-N 1 1 342.414 4.156 20 5 EIBDMO C[N@@H+](CCc1cccs1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172915137 1050232676 /nfs/dbraw/zinc/23/26/76/1050232676.db2.gz LQCSSDHGTRJDDZ-INIZCTEOSA-N 1 1 330.453 4.078 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCC[C@@H]1c1cccnc1)CC2 ZINC001172910383 1050245602 /nfs/dbraw/zinc/24/56/02/1050245602.db2.gz YJKFXNMIFUTZED-UYAOXDASSA-N 1 1 337.423 4.074 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+](Cc1ccco1)C1CC1)CC2 ZINC001172912490 1050246795 /nfs/dbraw/zinc/24/67/95/1050246795.db2.gz AHOHWOBHWFNHMO-MRXNPFEDSA-N 1 1 326.396 4.100 20 5 EIBDMO CC(C)Oc1ccccc1[C@H](C)[NH2+]Cc1cc(F)ccc1[N+](=O)[O-] ZINC000774983036 1050253976 /nfs/dbraw/zinc/25/39/76/1050253976.db2.gz UQECTAZYSAOULF-ZDUSSCGKSA-N 1 1 332.375 4.372 20 5 EIBDMO CC[N@@H+](Cc1ccc(OC)cc1)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173230728 1050359327 /nfs/dbraw/zinc/35/93/27/1050359327.db2.gz FAAFRKUKPWGCBO-HNNXBMFYSA-N 1 1 328.412 4.057 20 5 EIBDMO COc1ccccc1C[C@H](C)[N@@H+](C)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173231863 1050360711 /nfs/dbraw/zinc/36/07/11/1050360711.db2.gz OEOCZKLIINSKNS-CVEARBPZSA-N 1 1 342.439 4.097 20 5 EIBDMO COc1cccc([C@H]2CCC[N@H+]2[C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173234797 1050361678 /nfs/dbraw/zinc/36/16/78/1050361678.db2.gz UEQFQWHXKYFOEF-FOIQADDNSA-N 1 1 340.423 4.372 20 5 EIBDMO COc1ccc([C@H](C)[N@@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173234503 1050362377 /nfs/dbraw/zinc/36/23/77/1050362377.db2.gz RSPFFCBLXVFUCD-GJZGRUSLSA-N 1 1 328.412 4.227 20 5 EIBDMO COc1cccc(CCC[N@@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173235354 1050362439 /nfs/dbraw/zinc/36/24/39/1050362439.db2.gz WHYOOWGKGZYODU-MRXNPFEDSA-N 1 1 342.439 4.099 20 5 EIBDMO CC(C)Cc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)cn1 ZINC001178171074 1050407972 /nfs/dbraw/zinc/40/79/72/1050407972.db2.gz ORHWHTXSOYPFFL-UHFFFAOYSA-N 1 1 333.819 4.132 20 5 EIBDMO Cc1cc(Nc2ccc3[nH+]ccn3c2)c([N+](=O)[O-])cc1C(F)(F)F ZINC001187117095 1050478289 /nfs/dbraw/zinc/47/82/89/1050478289.db2.gz UWQNLVTYSCHOJM-UHFFFAOYSA-N 1 1 336.273 4.313 20 5 EIBDMO CC1(C)c2ccccc2CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000773759566 1050519182 /nfs/dbraw/zinc/51/91/82/1050519182.db2.gz FUYYKNIYDLIMBQ-UHFFFAOYSA-N 1 1 337.379 4.029 20 5 EIBDMO CC1(C)c2ccccc2CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000773759566 1050519194 /nfs/dbraw/zinc/51/91/94/1050519194.db2.gz FUYYKNIYDLIMBQ-UHFFFAOYSA-N 1 1 337.379 4.029 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccc3cnccc3c2)C2CC2)c1 ZINC000618808871 1050536495 /nfs/dbraw/zinc/53/64/95/1050536495.db2.gz AWYDPXZYRVWKRY-UHFFFAOYSA-N 1 1 333.391 4.308 20 5 EIBDMO CCOc1ccc(NC/C(C)=C/c2cccc([N+](=O)[O-])c2)[nH+]c1C ZINC001179232717 1050656354 /nfs/dbraw/zinc/65/63/54/1050656354.db2.gz ONFALEMZMCINBP-JLHYYAGUSA-N 1 1 327.384 4.212 20 5 EIBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)C/C(C)=C\c2cccc([N+](=O)[O-])c2)C12CCC2 ZINC001180132860 1050882595 /nfs/dbraw/zinc/88/25/95/1050882595.db2.gz NROXLBCEIQWAHL-VIZXMXCYSA-N 1 1 344.455 4.278 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCc2cc(F)ccc2C1 ZINC001180788267 1051077683 /nfs/dbraw/zinc/07/76/83/1051077683.db2.gz VKSURNCPNJTEQK-ZROIWOOFSA-N 1 1 326.371 4.196 20 5 EIBDMO CC(C)CC[N@H+](Cc1c(Br)cccc1[N+](=O)[O-])C1CC1 ZINC001190325199 1051154888 /nfs/dbraw/zinc/15/48/88/1051154888.db2.gz LOBNVQAJZGSDIS-UHFFFAOYSA-N 1 1 341.249 4.368 20 5 EIBDMO CC(C)CC[N@@H+](Cc1c(Br)cccc1[N+](=O)[O-])C1CC1 ZINC001190325199 1051154893 /nfs/dbraw/zinc/15/48/93/1051154893.db2.gz LOBNVQAJZGSDIS-UHFFFAOYSA-N 1 1 341.249 4.368 20 5 EIBDMO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC001190417544 1051178338 /nfs/dbraw/zinc/17/83/38/1051178338.db2.gz KTRHBJTVKKEMCP-ZDUSSCGKSA-N 1 1 334.803 4.320 20 5 EIBDMO CCn1c2ccccc2nc1[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1C ZINC000183647380 1051202709 /nfs/dbraw/zinc/20/27/09/1051202709.db2.gz OPPPLCKWXHXJIJ-AWEZNQCLSA-N 1 1 338.411 4.124 20 5 EIBDMO CC(C)([NH2+]Cc1cccc([N+](=O)[O-])c1)c1nc2ccccc2s1 ZINC001174934356 1051259720 /nfs/dbraw/zinc/25/97/20/1051259720.db2.gz TXSHPGUQLQSJGC-UHFFFAOYSA-N 1 1 327.409 4.229 20 5 EIBDMO C[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000183712552 1051309798 /nfs/dbraw/zinc/30/97/98/1051309798.db2.gz IVILMAPLDMAIQS-CQSZACIVSA-N 1 1 337.379 4.443 20 5 EIBDMO C[C@H](Cc1ccc(Cl)cc1)[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC001191003913 1051323805 /nfs/dbraw/zinc/32/38/05/1051323805.db2.gz LYGOTAJORWVVNH-GFCCVEGCSA-N 1 1 336.794 4.450 20 5 EIBDMO COc1ccc([C@H](C)C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC001192390194 1051712209 /nfs/dbraw/zinc/71/22/09/1051712209.db2.gz KYRQYWUDALPCPW-OAHLLOKOSA-N 1 1 340.423 4.372 20 5 EIBDMO CC[C@]1(CCc2ccccc2)CCC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC001175757333 1051769677 /nfs/dbraw/zinc/76/96/77/1051769677.db2.gz AZNVTBNPPQJZBM-HXUWFJFHSA-N 1 1 339.439 4.367 20 5 EIBDMO CC(C)[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC001193497562 1051934572 /nfs/dbraw/zinc/93/45/72/1051934572.db2.gz RSFBQJRDXFSJMC-LBPRGKRZSA-N 1 1 330.350 4.482 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3scnc3Cl)C2)cc1 ZINC001194476941 1052157079 /nfs/dbraw/zinc/15/70/79/1052157079.db2.gz FUHCDDUCPDPYIE-LBPRGKRZSA-N 1 1 337.832 4.084 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3scnc3Cl)C2)cc1 ZINC001194476941 1052157085 /nfs/dbraw/zinc/15/70/85/1052157085.db2.gz FUHCDDUCPDPYIE-LBPRGKRZSA-N 1 1 337.832 4.084 20 5 EIBDMO Cc1cccnc1[C@@H](C)[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC001176896737 1052207684 /nfs/dbraw/zinc/20/76/84/1052207684.db2.gz ICMKPBRPUPJPLM-SNVBAGLBSA-N 1 1 340.210 4.456 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000072558851 1052434803 /nfs/dbraw/zinc/43/48/03/1052434803.db2.gz UVVUDFSGJAUYSF-AWEZNQCLSA-N 1 1 348.406 4.321 20 5 EIBDMO CC(C)[C@@H](O)[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 ZINC000850394965 1053161436 /nfs/dbraw/zinc/16/14/36/1053161436.db2.gz KEZZEHCSVPIWFF-QZTJIDSGSA-N 1 1 348.830 4.096 20 5 EIBDMO CC[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC)c1ccccc1OC ZINC000850423006 1053194486 /nfs/dbraw/zinc/19/44/86/1053194486.db2.gz KRUYSHCPNFDUSR-GUYCJALGSA-N 1 1 344.411 4.414 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@H]([C@H]2CCCCO2)C1 ZINC000852594175 1053593341 /nfs/dbraw/zinc/59/33/41/1053593341.db2.gz AGQZIPXNMOTSDV-SUMWQHHRSA-N 1 1 338.835 4.029 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCC[C@@H](OC4CCC4)CC3)c2c1 ZINC000866145728 1053643499 /nfs/dbraw/zinc/64/34/99/1053643499.db2.gz PMPDGIHKUXBJMU-MRXNPFEDSA-N 1 1 341.411 4.071 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](N(C)c2ccccc2)C1 ZINC001196505718 1053686541 /nfs/dbraw/zinc/68/65/41/1053686541.db2.gz FRAZSLIGWCYGGP-LPHOPBHVSA-N 1 1 339.439 4.175 20 5 EIBDMO C[C@@H](NCc1cccc(C[NH+]2CCCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000173306393 1053971666 /nfs/dbraw/zinc/97/16/66/1053971666.db2.gz LNMCXVOWGFALSZ-MRXNPFEDSA-N 1 1 339.439 4.041 20 5 EIBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+](Cc1cccc(F)c1)C1CCC1 ZINC001197958941 1054037494 /nfs/dbraw/zinc/03/74/94/1054037494.db2.gz GTSKVHWOKFNBLO-UHFFFAOYSA-N 1 1 344.386 4.167 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@H]2[C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC001198010205 1054045922 /nfs/dbraw/zinc/04/59/22/1054045922.db2.gz FSYOHCVUIMZTHZ-YJBOKZPZSA-N 1 1 340.423 4.372 20 5 EIBDMO C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1cccc(OC(F)F)c1 ZINC000123470634 1054152866 /nfs/dbraw/zinc/15/28/66/1054152866.db2.gz RJTFYKJNXUMTBH-VIFPVBQESA-N 1 1 328.340 4.109 20 5 EIBDMO CC(C)[N@H+](C)Cc1cccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173358241 1054171495 /nfs/dbraw/zinc/17/14/95/1054171495.db2.gz NMFZGKHGPMFUTO-MRXNPFEDSA-N 1 1 341.455 4.286 20 5 EIBDMO CC(C)[N@@H+](C)Cc1cccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173358241 1054171506 /nfs/dbraw/zinc/17/15/06/1054171506.db2.gz NMFZGKHGPMFUTO-MRXNPFEDSA-N 1 1 341.455 4.286 20 5 EIBDMO CCOc1cc(C[N@@H+]2CCc3cc(C)cc(C)c3C2)ccc1[N+](=O)[O-] ZINC001198850783 1054275825 /nfs/dbraw/zinc/27/58/25/1054275825.db2.gz DEGLNRZHCZUKHS-UHFFFAOYSA-N 1 1 340.423 4.169 20 5 EIBDMO CCOc1cc(C[N@H+]2CCc3cc(C)cc(C)c3C2)ccc1[N+](=O)[O-] ZINC001198850783 1054275847 /nfs/dbraw/zinc/27/58/47/1054275847.db2.gz DEGLNRZHCZUKHS-UHFFFAOYSA-N 1 1 340.423 4.169 20 5 EIBDMO C[C@@H]([NH2+][C@H]1CSCc2ccccc21)c1c(F)cccc1[N+](=O)[O-] ZINC000872029528 1054347698 /nfs/dbraw/zinc/34/76/98/1054347698.db2.gz RGFNEPJJAKBNQN-ABAIWWIYSA-N 1 1 332.400 4.373 20 5 EIBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)c1c(C)noc1C ZINC000872035170 1054348859 /nfs/dbraw/zinc/34/88/59/1054348859.db2.gz NJRXIUJVRMTDPC-UWVGGRQHSA-N 1 1 335.429 4.333 20 5 EIBDMO COc1cccc2c1CC[C@@H]2[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872043461 1054355927 /nfs/dbraw/zinc/35/59/27/1054355927.db2.gz ICCBIGXAMJCPKP-ABAIWWIYSA-N 1 1 330.359 4.081 20 5 EIBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc(C)c(C)n1 ZINC000872078199 1054380949 /nfs/dbraw/zinc/38/09/49/1054380949.db2.gz FXWGEYCSVJWOEX-ZDUSSCGKSA-N 1 1 331.441 4.179 20 5 EIBDMO CC(C)c1ccc(CNC[C@H](C)[N@@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC001199295590 1054382209 /nfs/dbraw/zinc/38/22/09/1054382209.db2.gz KJPQWRJEEUWTRV-CVEARBPZSA-N 1 1 333.476 4.071 20 5 EIBDMO CC(C)c1ccc(CNC[C@H](C)[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC001199295590 1054382220 /nfs/dbraw/zinc/38/22/20/1054382220.db2.gz KJPQWRJEEUWTRV-CVEARBPZSA-N 1 1 333.476 4.071 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@H](c1ccccn1)C1CCC1 ZINC000859564191 1054696953 /nfs/dbraw/zinc/69/69/53/1054696953.db2.gz ZDAQYAKCZHDOCY-KRWDZBQOSA-N 1 1 331.803 4.274 20 5 EIBDMO CC(C)C[C@@]1(C)CCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878666851 1055368746 /nfs/dbraw/zinc/36/87/46/1055368746.db2.gz XJJOBJSZRJBOBO-GOSISDBHSA-N 1 1 344.415 4.045 20 5 EIBDMO CC(C)C[C@]1(C)CCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878666853 1055371030 /nfs/dbraw/zinc/37/10/30/1055371030.db2.gz XJJOBJSZRJBOBO-SFHVURJKSA-N 1 1 344.415 4.045 20 5 EIBDMO C[C@@H](NC[C@H](c1ccccc1)[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000326784568 1055519481 /nfs/dbraw/zinc/51/94/81/1055519481.db2.gz VLOMTXCGWPJHDY-OXQOHEQNSA-N 1 1 339.439 4.083 20 5 EIBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000301555411 1055729010 /nfs/dbraw/zinc/72/90/10/1055729010.db2.gz RYFZNFYBMFLHJR-GFCCVEGCSA-N 1 1 340.358 4.401 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1CCCc2cn(C(C)C)nc21 ZINC000765822231 1055753527 /nfs/dbraw/zinc/75/35/27/1055753527.db2.gz ZFKYTSGHINGXFR-RDTXWAMCSA-N 1 1 342.443 4.409 20 5 EIBDMO C[C@@H](c1ccc(OC(F)F)cc1)[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000445259225 1055823348 /nfs/dbraw/zinc/82/33/48/1055823348.db2.gz JYZZPXCEVVYAOI-LBPRGKRZSA-N 1 1 348.349 4.316 20 5 EIBDMO C[C@@H](c1ccc(OC(F)F)cc1)[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000445259225 1055823353 /nfs/dbraw/zinc/82/33/53/1055823353.db2.gz JYZZPXCEVVYAOI-LBPRGKRZSA-N 1 1 348.349 4.316 20 5 EIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](C)C(C)(C)C1 ZINC000273705705 1056089613 /nfs/dbraw/zinc/08/96/13/1056089613.db2.gz NKYVNZOFKRNXKV-CHWSQXEVSA-N 1 1 344.415 4.074 20 5 EIBDMO C[C@H]1C[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC[C@H]1c1ccccc1 ZINC000741807679 1058378114 /nfs/dbraw/zinc/37/81/14/1058378114.db2.gz JZUGMDZKUYONBQ-KBXCAEBGSA-N 1 1 328.387 4.360 20 5 EIBDMO Cc1cc(C)cc([C@H](O)C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000743258752 1058892832 /nfs/dbraw/zinc/89/28/32/1058892832.db2.gz WXPXVQDABZRQMK-GOSISDBHSA-N 1 1 348.830 4.030 20 5 EIBDMO Cc1cc(C)cc([C@H](O)C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000743258752 1058892836 /nfs/dbraw/zinc/89/28/36/1058892836.db2.gz WXPXVQDABZRQMK-GOSISDBHSA-N 1 1 348.830 4.030 20 5 EIBDMO COc1ccccc1C[C@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000743857874 1059169721 /nfs/dbraw/zinc/16/97/21/1059169721.db2.gz WNXVMOYCUNSKFK-ZDUSSCGKSA-N 1 1 348.830 4.320 20 5 EIBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)C1 ZINC001169033199 1060591098 /nfs/dbraw/zinc/59/10/98/1060591098.db2.gz BIYHWJQPDBYGNP-LRQRDZAKSA-N 1 1 336.435 4.080 20 5 EIBDMO C[C@@]12c3ccccc3[C@@H](Cc3ccccc31)[N@@H+]2[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169047472 1060603111 /nfs/dbraw/zinc/60/31/11/1060603111.db2.gz RFGBGFIEVOMLJA-NAYASGRBSA-N 1 1 348.446 4.308 20 5 EIBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCCCC[C@@H]1/C=C\c1ccccc1 ZINC001168144171 1032208902 /nfs/dbraw/zinc/20/89/02/1032208902.db2.gz BYJPRQZWGTYQCZ-SYGIOELKSA-N 1 1 337.423 4.448 20 5 EIBDMO COc1c(C)cnc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1C ZINC000532928199 1032395001 /nfs/dbraw/zinc/39/50/01/1032395001.db2.gz FPPODYACPFYNML-UHFFFAOYSA-N 1 1 343.427 4.026 20 5 EIBDMO COc1c(C)c[nH+]c(CN(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1C ZINC000532928199 1032395022 /nfs/dbraw/zinc/39/50/22/1032395022.db2.gz FPPODYACPFYNML-UHFFFAOYSA-N 1 1 343.427 4.026 20 5 EIBDMO CCCCC[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C(C)C ZINC000532919407 1032400433 /nfs/dbraw/zinc/40/04/33/1032400433.db2.gz WSKMTVXDVDDOJB-UHFFFAOYSA-N 1 1 332.404 4.045 20 5 EIBDMO C[C@@H]1C[C@@H](C)[C@H](C)[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000475721411 1032501343 /nfs/dbraw/zinc/50/13/43/1032501343.db2.gz AZNFBCZTZKPUIA-KFWWJZLASA-N 1 1 343.427 4.159 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]1c1cccn1C ZINC000533334738 1032664644 /nfs/dbraw/zinc/66/46/44/1032664644.db2.gz IOKNVEGBSJMYLF-SFHVURJKSA-N 1 1 343.427 4.058 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1c1cccn1C ZINC000533334738 1032664647 /nfs/dbraw/zinc/66/46/47/1032664647.db2.gz IOKNVEGBSJMYLF-SFHVURJKSA-N 1 1 343.427 4.058 20 5 EIBDMO CC(C)c1ccc(C[NH2+][C@H]2c3ccc(F)cc3O[C@@H]2C)cc1[N+](=O)[O-] ZINC000577557118 1018836680 /nfs/dbraw/zinc/83/66/80/1018836680.db2.gz WKQMOJYPDLIMDF-CWTRNNRKSA-N 1 1 344.386 4.469 20 5 EIBDMO CC[C@@H](C)[C@H](C)[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC1 ZINC000064809285 1019373970 /nfs/dbraw/zinc/37/39/70/1019373970.db2.gz AFOSLQCBALXFQG-OLZOCXBDSA-N 1 1 344.415 4.044 20 5 EIBDMO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1ccc([N+](=O)[O-])cc1OC ZINC000430221865 1019483780 /nfs/dbraw/zinc/48/37/80/1019483780.db2.gz URECEBDRZDZJCY-QGZVFWFLSA-N 1 1 344.411 4.243 20 5 EIBDMO COc1cc(C[N@H+](Cc2ccccc2C)C2CC2)c([N+](=O)[O-])cc1F ZINC001167227317 1020602433 /nfs/dbraw/zinc/60/24/33/1020602433.db2.gz KWIKCLZBZVNNGK-UHFFFAOYSA-N 1 1 344.386 4.216 20 5 EIBDMO COc1cc(C[N@@H+](Cc2ccccc2C)C2CC2)c([N+](=O)[O-])cc1F ZINC001167227317 1020602443 /nfs/dbraw/zinc/60/24/43/1020602443.db2.gz KWIKCLZBZVNNGK-UHFFFAOYSA-N 1 1 344.386 4.216 20 5 EIBDMO C[C@H]1CCC[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001167226696 1020603084 /nfs/dbraw/zinc/60/30/84/1020603084.db2.gz AAHQJXVDCNQILB-WCQYABFASA-N 1 1 341.249 4.368 20 5 EIBDMO CCOc1cc(C[N@H+]2C[C@@H](c3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC001167396957 1022006441 /nfs/dbraw/zinc/00/64/41/1022006441.db2.gz DCHWSUDNONGHOC-YJBOKZPZSA-N 1 1 340.423 4.372 20 5 EIBDMO O=[N+]([O-])c1cccc([C@H]([NH2+]Cc2cccc(O)c2)c2ccccc2)c1 ZINC000180389315 1022601517 /nfs/dbraw/zinc/60/15/17/1022601517.db2.gz PWVNVMSNRILXHA-HXUWFJFHSA-N 1 1 334.375 4.180 20 5 EIBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC001167437078 1022634592 /nfs/dbraw/zinc/63/45/92/1022634592.db2.gz BZJSFYLLCIABAC-FZMZJTMJSA-N 1 1 339.233 4.122 20 5 EIBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC001167437078 1022634609 /nfs/dbraw/zinc/63/46/09/1022634609.db2.gz BZJSFYLLCIABAC-FZMZJTMJSA-N 1 1 339.233 4.122 20 5 EIBDMO Cc1ccc(C[N@@H+]2CCC[C@@H]2c2cccc(N(C)C)c2)cc1[N+](=O)[O-] ZINC001167439453 1022716677 /nfs/dbraw/zinc/71/66/77/1022716677.db2.gz XFTTXXBXFQRJJN-LJQANCHMSA-N 1 1 339.439 4.306 20 5 EIBDMO Cc1ccc(C[N@@H+]2CCC[C@H]2c2cccc(N(C)C)c2)cc1[N+](=O)[O-] ZINC001167439452 1022717668 /nfs/dbraw/zinc/71/76/68/1022717668.db2.gz XFTTXXBXFQRJJN-IBGZPJMESA-N 1 1 339.439 4.306 20 5 EIBDMO C[C@@H]([NH2+][C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1 ZINC000007335631 1022761548 /nfs/dbraw/zinc/76/15/48/1022761548.db2.gz DWUCKVAOEJHTHG-OLZOCXBDSA-N 1 1 338.367 4.057 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](c1ccccn1)C1CCCC1 ZINC000378434403 1022816473 /nfs/dbraw/zinc/81/64/73/1022816473.db2.gz RPVQALVDVJTTCF-LJQANCHMSA-N 1 1 341.411 4.020 20 5 EIBDMO C[C@H]1[C@H](c2ccccc2)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000177551846 1022973808 /nfs/dbraw/zinc/97/38/08/1022973808.db2.gz FZWOCFFNQUYMSO-XJKSGUPXSA-N 1 1 337.379 4.114 20 5 EIBDMO CSCc1cccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000189478655 1023057542 /nfs/dbraw/zinc/05/75/42/1023057542.db2.gz QGQJPCIRWAEFFN-UHFFFAOYSA-N 1 1 336.844 4.401 20 5 EIBDMO COC[C@H]1CCCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000468695096 1023107490 /nfs/dbraw/zinc/10/74/90/1023107490.db2.gz RMLQVZQCGVSJDC-HNNXBMFYSA-N 1 1 344.411 4.103 20 5 EIBDMO CCCc1ncc(C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)o1 ZINC000417351992 1023287870 /nfs/dbraw/zinc/28/78/70/1023287870.db2.gz TYPANUYVOIMFFC-KRWDZBQOSA-N 1 1 329.400 4.093 20 5 EIBDMO CCOc1cc(C[N@H+]2CC[C@@H](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC001167482943 1023708480 /nfs/dbraw/zinc/70/84/80/1023708480.db2.gz RNGVNIZEYJZTKX-SFHVURJKSA-N 1 1 340.423 4.058 20 5 EIBDMO CC(C)C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccccc1 ZINC000610581590 1024112556 /nfs/dbraw/zinc/11/25/56/1024112556.db2.gz ZHSBPKJJOIUCMV-UHFFFAOYSA-N 1 1 339.395 4.394 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+](CC3CC3)C3CCCCC3)nc2c1 ZINC000610581342 1024114676 /nfs/dbraw/zinc/11/46/76/1024114676.db2.gz CKLOBCNYSNDQAI-UHFFFAOYSA-N 1 1 329.400 4.281 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H](C)S1 ZINC000092540275 1024801141 /nfs/dbraw/zinc/80/11/41/1024801141.db2.gz FGARRCJQHRHOJX-TXEJJXNPSA-N 1 1 349.481 4.044 20 5 EIBDMO C[C@@H]1C[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H](C)S1 ZINC000092540275 1024801143 /nfs/dbraw/zinc/80/11/43/1024801143.db2.gz FGARRCJQHRHOJX-TXEJJXNPSA-N 1 1 349.481 4.044 20 5 EIBDMO CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H](C)c1cccc(OC)c1 ZINC000065534246 1025725532 /nfs/dbraw/zinc/72/55/32/1025725532.db2.gz MDULDALQHCNWEX-OAHLLOKOSA-N 1 1 344.411 4.065 20 5 EIBDMO COc1ccc([C@H](C)[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])cc1F ZINC000182004137 1025777646 /nfs/dbraw/zinc/77/76/46/1025777646.db2.gz PNSZSRZHRRISDL-JTQLQIEISA-N 1 1 338.766 4.247 20 5 EIBDMO CC[C@@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1cccc([N+](=O)[O-])c1 ZINC000539063002 1025779232 /nfs/dbraw/zinc/77/92/32/1025779232.db2.gz NPKIJPKWRPEXQK-CVEARBPZSA-N 1 1 332.787 4.423 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCOc1ccccc1Cl ZINC000511058403 1026015766 /nfs/dbraw/zinc/01/57/66/1026015766.db2.gz RTCFXDDDOILVCI-CYBMUJFWSA-N 1 1 334.803 4.320 20 5 EIBDMO CC1(C)C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H]2CCC[C@H]21 ZINC000550076124 1026016856 /nfs/dbraw/zinc/01/68/56/1026016856.db2.gz KWNOXLWFSJACMW-IAGOWNOFSA-N 1 1 341.411 4.260 20 5 EIBDMO C[C@H](c1ccccn1)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000182065940 1026067474 /nfs/dbraw/zinc/06/74/74/1026067474.db2.gz ORWJNKIUWHRVCM-CQSZACIVSA-N 1 1 337.379 4.443 20 5 EIBDMO C[C@H]([NH2+]Cc1cc(F)c(Cl)cc1F)c1ccc([N+](=O)[O-])cc1 ZINC000432517521 1026278662 /nfs/dbraw/zinc/27/86/62/1026278662.db2.gz GMXGDBHJVAFAGU-VIFPVBQESA-N 1 1 326.730 4.377 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)cc(Cl)c1NC[C@@H]1CCCn2cc[nH+]c21 ZINC000342779531 1026488955 /nfs/dbraw/zinc/48/89/55/1026488955.db2.gz KRBVJZIFKLUGEE-VIFPVBQESA-N 1 1 341.198 4.088 20 5 EIBDMO CC[C@H]([NH2+][C@H](C)c1nc2c(s1)CCC2)c1cccc([N+](=O)[O-])c1 ZINC000135063011 1026541493 /nfs/dbraw/zinc/54/14/93/1026541493.db2.gz IYAAEZJSCIDAFE-RISCZKNCSA-N 1 1 331.441 4.342 20 5 EIBDMO COc1cc(C[N@@H+]([C@H](C)c2ccccc2)C2CC2)ccc1[N+](=O)[O-] ZINC000512241552 1026566339 /nfs/dbraw/zinc/56/63/39/1026566339.db2.gz HCGALVVXPGMYOH-CQSZACIVSA-N 1 1 326.396 4.329 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc(Br)c1 ZINC000479560783 1026838894 /nfs/dbraw/zinc/83/88/94/1026838894.db2.gz ZKFPJNLNSCGOIX-UHFFFAOYSA-N 1 1 349.228 4.379 20 5 EIBDMO C[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccs1 ZINC000078338434 1027321974 /nfs/dbraw/zinc/32/19/74/1027321974.db2.gz PSGMHJWUWKUZMX-CXAGYDPISA-N 1 1 331.441 4.151 20 5 EIBDMO C[C@H]1C[C@@H](c2cccc(F)c2)[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000441323433 1027448425 /nfs/dbraw/zinc/44/84/25/1027448425.db2.gz MZZHQXBTCKIITJ-KSSFIOAISA-N 1 1 344.386 4.196 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+](C3CC3)[C@H]3CCc4ccccc43)nc2c1 ZINC000444652943 1027924034 /nfs/dbraw/zinc/92/40/34/1027924034.db2.gz UYCOQQGURNTQDF-IBGZPJMESA-N 1 1 348.406 4.123 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+](C3CC3)[C@H]3CCc4ccccc43)nc2c1 ZINC000444652943 1027924059 /nfs/dbraw/zinc/92/40/59/1027924059.db2.gz UYCOQQGURNTQDF-IBGZPJMESA-N 1 1 348.406 4.123 20 5 EIBDMO CC(C)[C@@H](c1ccccc1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444640883 1027937206 /nfs/dbraw/zinc/93/72/06/1027937206.db2.gz CUALVXOJBPAWBE-IBGZPJMESA-N 1 1 338.411 4.300 20 5 EIBDMO C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCc2ccccc2C1 ZINC000522558078 1028003153 /nfs/dbraw/zinc/00/31/53/1028003153.db2.gz UMJGRKVCYHQPDB-KRWDZBQOSA-N 1 1 330.815 4.238 20 5 EIBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC000524425154 1028914119 /nfs/dbraw/zinc/91/41/19/1028914119.db2.gz XDHZZYCLGUGUHT-INIZCTEOSA-N 1 1 330.815 4.280 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3ccccn3)CC2)cc1Cl ZINC000783548433 1029060628 /nfs/dbraw/zinc/06/06/28/1029060628.db2.gz QFBOOAYMEGTVER-UHFFFAOYSA-N 1 1 331.803 4.023 20 5 EIBDMO CC1(C)CCCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000446073632 1029133530 /nfs/dbraw/zinc/13/35/30/1029133530.db2.gz PHBWMXLYTGYPQD-UHFFFAOYSA-N 1 1 329.400 4.262 20 5 EIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCCCC(C)(C)C1 ZINC000446074972 1029133954 /nfs/dbraw/zinc/13/39/54/1029133954.db2.gz USSQLKQBMZJAQF-CYBMUJFWSA-N 1 1 344.415 4.218 20 5 EIBDMO CCc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)o1 ZINC000278773454 1029973167 /nfs/dbraw/zinc/97/31/67/1029973167.db2.gz OXQBGASEMBMOSM-UHFFFAOYSA-N 1 1 328.290 4.059 20 5 EIBDMO COc1cccc(Cl)c1C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447603120 1030223608 /nfs/dbraw/zinc/22/36/08/1030223608.db2.gz WSFQVPFFEKSFMQ-QGZVFWFLSA-N 1 1 346.814 4.424 20 5 EIBDMO COc1cc(C[NH2+][C@H](C)c2ccc(F)cc2Cl)ccc1[N+](=O)[O-] ZINC000451113480 1030238056 /nfs/dbraw/zinc/23/80/56/1030238056.db2.gz YUUNJWFOACONTM-SNVBAGLBSA-N 1 1 338.766 4.247 20 5 EIBDMO CC(=O)c1cccc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000451552195 1030573213 /nfs/dbraw/zinc/57/32/13/1030573213.db2.gz VZDRNRIFFOMKQK-LJQANCHMSA-N 1 1 338.407 4.177 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC(c2ccncc2)CC1 ZINC000191662222 1031096431 /nfs/dbraw/zinc/09/64/31/1031096431.db2.gz FCSBYGKHCCATOL-UHFFFAOYSA-N 1 1 331.803 4.023 20 5 EIBDMO COc1ccc(C[N@@H+]2[C@H](C)[C@H](CC(F)(F)F)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000449357994 1031679490 /nfs/dbraw/zinc/67/94/90/1031679490.db2.gz BNZAAEXLNSVRML-LOWVWBTDSA-N 1 1 346.349 4.155 20 5 EIBDMO COC[C@@]1(C)CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000449397884 1031701242 /nfs/dbraw/zinc/70/12/42/1031701242.db2.gz WGRGZKBLMGIFCA-SFHVURJKSA-N 1 1 346.452 4.182 20 5 EIBDMO C[C@H](N[C@@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000453222233 1031741201 /nfs/dbraw/zinc/74/12/01/1031741201.db2.gz KZGMSUQFIUJAQE-CVAIRZPRSA-N 1 1 339.439 4.081 20 5 EIBDMO C[C@H](N[C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000453222233 1031741211 /nfs/dbraw/zinc/74/12/11/1031741211.db2.gz KZGMSUQFIUJAQE-CVAIRZPRSA-N 1 1 339.439 4.081 20 5 EIBDMO C[C@@H]([NH2+][C@H]1CCc2cc(F)c(F)c(F)c21)c1ccc([N+](=O)[O-])cc1 ZINC000453337343 1031862049 /nfs/dbraw/zinc/86/20/49/1031862049.db2.gz JRTUKGFSVLOVCL-OTYXRUKQSA-N 1 1 336.313 4.350 20 5 EIBDMO CCc1nc(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cs1 ZINC000433177449 1033989552 /nfs/dbraw/zinc/98/95/52/1033989552.db2.gz QQYGGSDWXIYQME-HNNXBMFYSA-N 1 1 331.441 4.126 20 5 EIBDMO Cc1ccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])c(OC(C)(C)C)c1 ZINC000150971801 1034065632 /nfs/dbraw/zinc/06/56/32/1034065632.db2.gz CIZIWPLHHFRXMZ-UHFFFAOYSA-N 1 1 328.412 4.370 20 5 EIBDMO COC[C@@H]([NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccc(C)o1 ZINC000433293330 1034183612 /nfs/dbraw/zinc/18/36/12/1034183612.db2.gz DNCDXMKXUHZJMC-DLBZAZTESA-N 1 1 344.411 4.196 20 5 EIBDMO CC(C)[C@@H](O)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000594988667 1035517807 /nfs/dbraw/zinc/51/78/07/1035517807.db2.gz ASINDYXDXWQIEJ-ZWKOTPCHSA-N 1 1 348.830 4.096 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1cccc(OC(F)F)c1 ZINC000595417265 1035673598 /nfs/dbraw/zinc/67/35/98/1035673598.db2.gz VKAWSOSMGKNXSS-SNVBAGLBSA-N 1 1 340.301 4.186 20 5 EIBDMO C[C@@H]([NH2+]Cc1cccc(F)c1OC(F)F)c1cccc([N+](=O)[O-])c1 ZINC000595414971 1035673830 /nfs/dbraw/zinc/67/38/30/1035673830.db2.gz PAWCABVVPRCVAY-SNVBAGLBSA-N 1 1 340.301 4.186 20 5 EIBDMO COc1cccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1Cl ZINC000595419784 1035676169 /nfs/dbraw/zinc/67/61/69/1035676169.db2.gz KYMLISUYSCUVRO-GFCCVEGCSA-N 1 1 334.803 4.416 20 5 EIBDMO COc1cccc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c1Cl ZINC000595512843 1035692663 /nfs/dbraw/zinc/69/26/63/1035692663.db2.gz WLEIYUNONKKYBI-UHFFFAOYSA-N 1 1 334.803 4.282 20 5 EIBDMO CC(C)=CCC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000595564080 1035696166 /nfs/dbraw/zinc/69/61/66/1035696166.db2.gz WLPSDAKAVHEOBU-IYARVYRRSA-N 1 1 332.444 4.057 20 5 EIBDMO CC(C)[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1F ZINC000595686267 1035761058 /nfs/dbraw/zinc/76/10/58/1035761058.db2.gz UYQMHVNWTZKGOI-SFHVURJKSA-N 1 1 343.358 4.362 20 5 EIBDMO Cc1cc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c(C)s1 ZINC000284027772 1035804636 /nfs/dbraw/zinc/80/46/36/1035804636.db2.gz IFSPHCAKCVNBFL-SNVBAGLBSA-N 1 1 335.385 4.032 20 5 EIBDMO C[N@@H+]1Cc2ccccc2[C@H](Nc2ccc(C(F)F)cc2[N+](=O)[O-])C1 ZINC000596176171 1035833900 /nfs/dbraw/zinc/83/39/00/1035833900.db2.gz ZMUJEYNLWGTNJT-OAHLLOKOSA-N 1 1 333.338 4.131 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](CC(F)F)c1ccccc1 ZINC000421000884 1035942283 /nfs/dbraw/zinc/94/22/83/1035942283.db2.gz WQYTYQUPOYIJKP-OAHLLOKOSA-N 1 1 336.338 4.090 20 5 EIBDMO CC[C@H]1c2ccsc2CC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000485740623 1036232739 /nfs/dbraw/zinc/23/27/39/1036232739.db2.gz WYLHWOHALQBDDV-AWEZNQCLSA-N 1 1 332.425 4.174 20 5 EIBDMO CC[C@H]1c2ccsc2CC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000485740623 1036232759 /nfs/dbraw/zinc/23/27/59/1036232759.db2.gz WYLHWOHALQBDDV-AWEZNQCLSA-N 1 1 332.425 4.174 20 5 EIBDMO COc1cc(C[N@@H+](C)Cc2csc3ccccc23)ccc1[N+](=O)[O-] ZINC000485787542 1036274724 /nfs/dbraw/zinc/27/47/24/1036274724.db2.gz DEVPWDISQVTCTH-UHFFFAOYSA-N 1 1 342.420 4.450 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1nsc3ccccc13)CCC2 ZINC000603430064 1036837131 /nfs/dbraw/zinc/83/71/31/1036837131.db2.gz RALPWHBSHPPGTC-MRXNPFEDSA-N 1 1 339.420 4.372 20 5 EIBDMO CC(C)CC[C@@H]1CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000486779734 1036850164 /nfs/dbraw/zinc/85/01/64/1036850164.db2.gz NRMCFTWVRXIYDE-HNNXBMFYSA-N 1 1 344.415 4.045 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](c1ccccn1)C1CCC1 ZINC000599068005 1036868419 /nfs/dbraw/zinc/86/84/19/1036868419.db2.gz JPKYXUCWNSWFAR-BFUOFWGJSA-N 1 1 341.411 4.190 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](c2ccccn2)C1 ZINC000590599982 1037115046 /nfs/dbraw/zinc/11/50/46/1037115046.db2.gz INPBYQXFNFVGBK-CVEARBPZSA-N 1 1 325.412 4.239 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H](C)C2CC2)cc1 ZINC000057601467 1037135966 /nfs/dbraw/zinc/13/59/66/1037135966.db2.gz HUASFFJJQIQFQQ-HNNXBMFYSA-N 1 1 340.423 4.404 20 5 EIBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@H]2c2cccs2)cc1 ZINC000604012604 1037148381 /nfs/dbraw/zinc/14/83/81/1037148381.db2.gz VRTIFTIBEOAUHL-INIZCTEOSA-N 1 1 332.425 4.262 20 5 EIBDMO COc1ccc2c(c1)CCC[C@@H]2[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000604492778 1037406998 /nfs/dbraw/zinc/40/69/98/1037406998.db2.gz UNTNRYNVEQCMHO-FQEVSTJZSA-N 1 1 340.423 4.155 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2ccnc(Oc3ccccc3)c2)cs1 ZINC000604532236 1037427559 /nfs/dbraw/zinc/42/75/59/1037427559.db2.gz ONVNFKVQVRILNH-UHFFFAOYSA-N 1 1 341.392 4.133 20 5 EIBDMO CCOc1cc(C[NH2+]C2(c3ccccc3F)CCC2)ccc1[N+](=O)[O-] ZINC000592144178 1037748139 /nfs/dbraw/zinc/74/81/39/1037748139.db2.gz AIHKNVGBEBOOCS-UHFFFAOYSA-N 1 1 344.386 4.302 20 5 EIBDMO COc1ccccc1C1([NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000592393102 1037784520 /nfs/dbraw/zinc/78/45/20/1037784520.db2.gz DGEPVJPAEOVXMQ-AWEZNQCLSA-N 1 1 326.396 4.252 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)C[C@H]1OCCc2ccccc21 ZINC000489150033 1037882517 /nfs/dbraw/zinc/88/25/17/1037882517.db2.gz AJPDUKOAJQBGSI-MGPUTAFESA-N 1 1 340.423 4.210 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC(OC3CCCC3)CC2)c1 ZINC000172177334 1037888653 /nfs/dbraw/zinc/88/86/53/1037888653.db2.gz VLQXVSUKGAHEOG-UHFFFAOYSA-N 1 1 338.835 4.172 20 5 EIBDMO Cc1csc([C@H]2CCC[N@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000249909135 1037892255 /nfs/dbraw/zinc/89/22/55/1037892255.db2.gz VPQOIYZFELTWJW-HIFRSBDPSA-N 1 1 331.441 4.300 20 5 EIBDMO CC(C)c1ccc(C[N@H+]2CC[C@@H](c3cccnc3)C2)cc1[N+](=O)[O-] ZINC000592520035 1038141228 /nfs/dbraw/zinc/14/12/28/1038141228.db2.gz CFYMKWNBKHIJEF-QGZVFWFLSA-N 1 1 325.412 4.103 20 5 EIBDMO CO[C@@H](C)C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)C ZINC000537616285 1038897241 /nfs/dbraw/zinc/89/72/41/1038897241.db2.gz MPLLZWXZTRDDQR-AWEZNQCLSA-N 1 1 332.400 4.100 20 5 EIBDMO CC(C)c1ccc(C[N@H+]2CCC[C@]3(CCCOC3)C2)cc1[N+](=O)[O-] ZINC000537616863 1038910868 /nfs/dbraw/zinc/91/08/68/1038910868.db2.gz YKZJMGVJNGORJL-IBGZPJMESA-N 1 1 332.444 4.111 20 5 EIBDMO C[C@@H]1CC[C@@H](C)[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000537619616 1038951410 /nfs/dbraw/zinc/95/14/10/1038951410.db2.gz HQHFWUWTEWNRTK-CHWSQXEVSA-N 1 1 331.441 4.339 20 5 EIBDMO C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CCCCC1 ZINC000505331263 1039229421 /nfs/dbraw/zinc/22/94/21/1039229421.db2.gz PLLGWLXBVXYSKG-UHFFFAOYSA-N 1 1 331.441 4.483 20 5 EIBDMO CCC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000537635585 1039333806 /nfs/dbraw/zinc/33/38/06/1039333806.db2.gz DMZYTCPULDMQFK-LJKRUFLISA-N 1 1 344.455 4.134 20 5 EIBDMO Cc1c(C[NH2+][C@@H](C)c2nc3c(s2)CCCC3)cccc1[N+](=O)[O-] ZINC000478500917 1039792772 /nfs/dbraw/zinc/79/27/72/1039792772.db2.gz WLHPCDHCIAYLEC-LBPRGKRZSA-N 1 1 331.441 4.089 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@@H]3Cc3ccccc3)co2)cc1 ZINC000534842226 1039817757 /nfs/dbraw/zinc/81/77/57/1039817757.db2.gz SGTBIDGFSCKAMX-LJQANCHMSA-N 1 1 349.390 4.067 20 5 EIBDMO COc1cccc(F)c1[C@H](C)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192904821 1039851585 /nfs/dbraw/zinc/85/15/85/1039851585.db2.gz SSZUYSZYVGJURR-YVEFUNNKSA-N 1 1 344.386 4.471 20 5 EIBDMO C[N@@H+](Cc1ccc[nH]1)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000537659295 1039861562 /nfs/dbraw/zinc/86/15/62/1039861562.db2.gz LJSZSCGXEOXESF-UHFFFAOYSA-N 1 1 327.409 4.283 20 5 EIBDMO CCC[N@@H+](Cc1ccccc1)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000505615746 1040105991 /nfs/dbraw/zinc/10/59/91/1040105991.db2.gz UQGBSPHNEBJZPV-UHFFFAOYSA-N 1 1 344.411 4.024 20 5 EIBDMO CC(C)[N@@H+](CCc1nccs1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000159804659 1040211988 /nfs/dbraw/zinc/21/19/88/1040211988.db2.gz DPBFYGZKANDCMC-UHFFFAOYSA-N 1 1 339.848 4.158 20 5 EIBDMO C[C@H](c1ccsc1)[NH+]1CCN([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000462446914 1040613406 /nfs/dbraw/zinc/61/34/06/1040613406.db2.gz LZNLTRXTBZFQRC-CABCVRRESA-N 1 1 345.468 4.096 20 5 EIBDMO Cc1c([C@H](C)[NH2+][C@@H]2c3ccc(F)cc3O[C@@H]2C)cccc1[N+](=O)[O-] ZINC000554089415 1040797621 /nfs/dbraw/zinc/79/76/21/1040797621.db2.gz YDFRCRKJYRWANP-IUUKEHGRSA-N 1 1 330.359 4.215 20 5 EIBDMO CCCCO[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)C1(C)C ZINC001167960102 1040805331 /nfs/dbraw/zinc/80/53/31/1040805331.db2.gz SCCZYVQSLMTJLU-IAGOWNOFSA-N 1 1 338.423 4.150 20 5 EIBDMO Cc1ccc(C[N@H+]2CCC[C@@H]2CC(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000539837347 1040833510 /nfs/dbraw/zinc/83/35/10/1040833510.db2.gz UEPZZLZZFVLXFT-GOSISDBHSA-N 1 1 338.407 4.141 20 5 EIBDMO CC1(C)C[N@H+](Cc2ccc([N+](=O)[O-])cc2F)CC[C@H]1C(F)(F)F ZINC000483426596 1040851661 /nfs/dbraw/zinc/85/16/61/1040851661.db2.gz FNKGQPAYYLTNCV-CYBMUJFWSA-N 1 1 334.313 4.144 20 5 EIBDMO CC1(C)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)CC[C@H]1C(F)(F)F ZINC000483426596 1040851664 /nfs/dbraw/zinc/85/16/64/1040851664.db2.gz FNKGQPAYYLTNCV-CYBMUJFWSA-N 1 1 334.313 4.144 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](C(F)(F)F)C(C)(C)C1 ZINC000483448806 1040855293 /nfs/dbraw/zinc/85/52/93/1040855293.db2.gz NNGFUFAADZSEGG-CQSZACIVSA-N 1 1 330.350 4.314 20 5 EIBDMO CC(C)CO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000539927293 1040898862 /nfs/dbraw/zinc/89/88/62/1040898862.db2.gz MNFMFOBSJVICQY-OAHLLOKOSA-N 1 1 344.411 4.102 20 5 EIBDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000483644755 1040926961 /nfs/dbraw/zinc/92/69/61/1040926961.db2.gz FOYLEEXQPLCIGC-LBPRGKRZSA-N 1 1 334.803 4.017 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1COc2ccc(Cl)cc21 ZINC000540161670 1041195503 /nfs/dbraw/zinc/19/55/03/1041195503.db2.gz YXAJDNMIFVKSQP-BDJLRTHQSA-N 1 1 332.787 4.341 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC[C@@H](COc2ccccc2)C1 ZINC000505819282 1041239786 /nfs/dbraw/zinc/23/97/86/1041239786.db2.gz MPSTYLGXGDQGSQ-CQSZACIVSA-N 1 1 346.814 4.149 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@@H](COc2ccccc2)C1 ZINC000505819282 1041239806 /nfs/dbraw/zinc/23/98/06/1041239806.db2.gz MPSTYLGXGDQGSQ-CQSZACIVSA-N 1 1 346.814 4.149 20 5 EIBDMO Cc1c(C[NH2+]Cc2csc(-c3ccsc3)n2)cccc1[N+](=O)[O-] ZINC000480446373 1041308110 /nfs/dbraw/zinc/30/81/10/1041308110.db2.gz QLFOTBDLMHIVGW-UHFFFAOYSA-N 1 1 345.449 4.378 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)C3(CCC3)C2)cc1 ZINC000554846066 1041445777 /nfs/dbraw/zinc/44/57/77/1041445777.db2.gz JLOCUNUTMHACGC-CQSZACIVSA-N 1 1 328.334 4.149 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCO[C@](C)(c2ccccc2)C1 ZINC000538709457 1041482882 /nfs/dbraw/zinc/48/28/82/1041482882.db2.gz PVYOBXFOVRRDSJ-UZLBHIALSA-N 1 1 340.423 4.212 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCO[C@](C)(c2ccccc2)C1 ZINC000538709457 1041482889 /nfs/dbraw/zinc/48/28/89/1041482889.db2.gz PVYOBXFOVRRDSJ-UZLBHIALSA-N 1 1 340.423 4.212 20 5 EIBDMO CC[N@@H+](CCc1nccs1)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000470178737 1041569724 /nfs/dbraw/zinc/56/97/24/1041569724.db2.gz NCEQLGGPQGPCFE-KAMYIIQDSA-N 1 1 331.441 4.019 20 5 EIBDMO COc1cc(C[N@@H+](C)[C@H]2CCCC[C@H]2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000463451709 1041572686 /nfs/dbraw/zinc/57/26/86/1041572686.db2.gz XJQYSVQNODSXSW-OLZOCXBDSA-N 1 1 346.349 4.156 20 5 EIBDMO Cc1ccsc1C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000506031072 1041759739 /nfs/dbraw/zinc/75/97/39/1041759739.db2.gz NNBMTWZXDSSZGL-UHFFFAOYSA-N 1 1 342.367 4.198 20 5 EIBDMO Cc1ccsc1C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000506031072 1041759751 /nfs/dbraw/zinc/75/97/51/1041759751.db2.gz NNBMTWZXDSSZGL-UHFFFAOYSA-N 1 1 342.367 4.198 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cc3c(cccc3F)[nH]2)C2CC2)cc1 ZINC000437574387 1041843200 /nfs/dbraw/zinc/84/32/00/1041843200.db2.gz FGOBFHXAZLOJGI-UHFFFAOYSA-N 1 1 339.370 4.380 20 5 EIBDMO C[C@@H]1CCC[C@H]([N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000506178217 1042060120 /nfs/dbraw/zinc/06/01/20/1042060120.db2.gz IRDPFZZAMHZLDR-KDOFPFPSSA-N 1 1 342.443 4.006 20 5 EIBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@H]1CCSC1 ZINC000506193670 1042099732 /nfs/dbraw/zinc/09/97/32/1042099732.db2.gz XPHWWUGVNPRENW-GFCCVEGCSA-N 1 1 334.466 4.261 20 5 EIBDMO CCC[N@H+](Cc1ccc(OC)cc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000609144594 1042255366 /nfs/dbraw/zinc/25/53/66/1042255366.db2.gz GBJGKIPEKBOMBT-UHFFFAOYSA-N 1 1 332.375 4.155 20 5 EIBDMO CCC[N@@H+](Cc1ccc(OC)cc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000609144594 1042255386 /nfs/dbraw/zinc/25/53/86/1042255386.db2.gz GBJGKIPEKBOMBT-UHFFFAOYSA-N 1 1 332.375 4.155 20 5 EIBDMO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1ccc([N+](=O)[O-])cc1C)CCC2 ZINC000518011858 1042311917 /nfs/dbraw/zinc/31/19/17/1042311917.db2.gz VXTQDDXGXHAEFU-MRXNPFEDSA-N 1 1 345.468 4.432 20 5 EIBDMO COc1ccccc1[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000108421259 1042412320 /nfs/dbraw/zinc/41/23/20/1042412320.db2.gz AIXAUSDBKLGJDY-OAQYLSRUSA-N 1 1 348.402 4.483 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC=C(c3c[nH]c4ccccc34)CC2)cc1 ZINC000492464622 1042659729 /nfs/dbraw/zinc/65/97/29/1042659729.db2.gz LZUHTWQFTFBONZ-UHFFFAOYSA-N 1 1 333.391 4.365 20 5 EIBDMO CC(C)[N@H+](C)CCCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000518770480 1042684592 /nfs/dbraw/zinc/68/45/92/1042684592.db2.gz MIIGWNYDJCOSKP-UHFFFAOYSA-N 1 1 347.484 4.143 20 5 EIBDMO CC(C)[N@@H+](C)CCCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000518770480 1042684596 /nfs/dbraw/zinc/68/45/96/1042684596.db2.gz MIIGWNYDJCOSKP-UHFFFAOYSA-N 1 1 347.484 4.143 20 5 EIBDMO CCOc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000761511257 1042873303 /nfs/dbraw/zinc/87/33/03/1042873303.db2.gz OSMQFHGJPFYGCE-UHFFFAOYSA-N 1 1 334.803 4.279 20 5 EIBDMO CC(C)(C)OC1CC[NH+](Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000493366618 1042898338 /nfs/dbraw/zinc/89/83/38/1042898338.db2.gz SVJBDNNCAHDZPF-UHFFFAOYSA-N 1 1 326.824 4.028 20 5 EIBDMO CCC(C)(C)[C@H]1CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000441638264 1042948083 /nfs/dbraw/zinc/94/80/83/1042948083.db2.gz WVOKCJFVONCTSZ-OAHLLOKOSA-N 1 1 344.415 4.045 20 5 EIBDMO CC[N@@H+](Cc1ccc(C(C)C)c([N+](=O)[O-])c1)[C@H]1CCOC(C)(C)C1 ZINC000579537324 1042955900 /nfs/dbraw/zinc/95/59/00/1042955900.db2.gz CYNVLOYIPGUABA-INIZCTEOSA-N 1 1 334.460 4.498 20 5 EIBDMO CSc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000520665659 1042989207 /nfs/dbraw/zinc/98/92/07/1042989207.db2.gz YMAZGJDWIKNICN-UHFFFAOYSA-N 1 1 328.846 4.321 20 5 EIBDMO Cc1cnc([C@@H]([NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)C2CC2)s1 ZINC000120940948 1043092208 /nfs/dbraw/zinc/09/22/08/1043092208.db2.gz DIWYDOWPGYYLNL-WBMJQRKESA-N 1 1 331.441 4.470 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(COc2ccccc2)CC1 ZINC000509157454 1043095325 /nfs/dbraw/zinc/09/53/25/1043095325.db2.gz UGKONKKFDBFMCZ-UHFFFAOYSA-N 1 1 344.386 4.025 20 5 EIBDMO CC(C)C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CC1 ZINC000507997537 1043232334 /nfs/dbraw/zinc/23/23/34/1043232334.db2.gz HWIHAJXFWQESCZ-UHFFFAOYSA-N 1 1 331.441 4.339 20 5 EIBDMO CC(C)([NH2+]Cc1ccccc1Br)c1ccc([N+](=O)[O-])cc1 ZINC000080347290 1044157479 /nfs/dbraw/zinc/15/74/79/1044157479.db2.gz VMUMWIHVYYNYCV-UHFFFAOYSA-N 1 1 349.228 4.382 20 5 EIBDMO CC[C@H](C)C[N@@H+](CC)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000245936329 1044214260 /nfs/dbraw/zinc/21/42/60/1044214260.db2.gz ZMUMNLQRPFLOKV-QWHCGFSZSA-N 1 1 332.404 4.074 20 5 EIBDMO CCC[C@@H]([NH2+]Cc1nccn1CC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000164808864 1044510256 /nfs/dbraw/zinc/51/02/56/1044510256.db2.gz CBIUAJTVJQTLNG-QGZVFWFLSA-N 1 1 330.432 4.078 20 5 EIBDMO Cc1cc(N[C@@H]2CC[N@H+](C)[C@@H]2c2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000301970629 1044529723 /nfs/dbraw/zinc/52/97/23/1044529723.db2.gz DVXYYXGKLROEEG-SJLPKXTDSA-N 1 1 347.365 4.039 20 5 EIBDMO CC[C@@H]([NH2+]Cc1c(Cl)cccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000323405086 1044763522 /nfs/dbraw/zinc/76/35/22/1044763522.db2.gz VBOLPVLXMKZPKW-MRXNPFEDSA-N 1 1 334.803 4.498 20 5 EIBDMO CC(C)[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000428865827 1044776432 /nfs/dbraw/zinc/77/64/32/1044776432.db2.gz HJQMFAUVGFKQQT-OAHLLOKOSA-N 1 1 341.411 4.005 20 5 EIBDMO Cc1nc(C)c([C@@H](C)[N@@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])s1 ZINC000093274874 1044827484 /nfs/dbraw/zinc/82/74/84/1044827484.db2.gz LGNGVWOBHYHUGD-BUUCAEBMSA-N 1 1 331.441 4.374 20 5 EIBDMO CC(C)CCOC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000735491405 1044831862 /nfs/dbraw/zinc/83/18/62/1044831862.db2.gz KKHBJEJOTWHVPD-UHFFFAOYSA-N 1 1 340.851 4.275 20 5 EIBDMO COc1ccc(CCC[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000735491636 1044832938 /nfs/dbraw/zinc/83/29/38/1044832938.db2.gz NUBFYIKDOAYMIK-UHFFFAOYSA-N 1 1 348.830 4.321 20 5 EIBDMO CCS[C@H]1CCCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000735493295 1044832973 /nfs/dbraw/zinc/83/29/73/1044832973.db2.gz OCAORVVGLCEKPO-AWEZNQCLSA-N 1 1 328.865 4.356 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(N[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C)c1 ZINC000716233014 1044853001 /nfs/dbraw/zinc/85/30/01/1044853001.db2.gz TYZRNLKQBIXQFC-QFBILLFUSA-N 1 1 339.439 4.226 20 5 EIBDMO C[C@@]1([NH2+]Cc2c(F)cc([N+](=O)[O-])cc2F)CCCc2ccccc21 ZINC000508993984 1044883883 /nfs/dbraw/zinc/88/38/83/1044883883.db2.gz ZPZBIMSRPAPSBE-GOSISDBHSA-N 1 1 332.350 4.214 20 5 EIBDMO C[C@H]([NH2+][C@H](c1ccccc1)c1ccncc1)c1ccc([N+](=O)[O-])cc1 ZINC000156287415 1045034758 /nfs/dbraw/zinc/03/47/58/1045034758.db2.gz ZLQKAEKLURSYNT-MGPUTAFESA-N 1 1 333.391 4.430 20 5 EIBDMO CCC[C@@H]([NH2+][C@H](COC)c1ccc(C)o1)c1cccc([N+](=O)[O-])c1 ZINC000156453525 1045057924 /nfs/dbraw/zinc/05/79/24/1045057924.db2.gz UZQMAOCAXUIHQU-IAGOWNOFSA-N 1 1 332.400 4.315 20 5 EIBDMO C[C@H]1C[C@H](Nc2sccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000302032185 1045155148 /nfs/dbraw/zinc/15/51/48/1045155148.db2.gz SMYYEOQBLLEENJ-DZGCQCFKSA-N 1 1 331.441 4.121 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC(c2cccnc2)CC1 ZINC000611258804 1045269033 /nfs/dbraw/zinc/26/90/33/1045269033.db2.gz OKLSSJUVZGDPDD-UHFFFAOYSA-N 1 1 331.803 4.023 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H](c3ccco3)C2)o1 ZINC000611271288 1045272279 /nfs/dbraw/zinc/27/22/79/1045272279.db2.gz LPBFIDPLVBXXEX-CQSZACIVSA-N 1 1 338.363 4.437 20 5 EIBDMO Cc1c([C@@H](C)[NH2+][C@@H]2COc3c2cccc3Cl)cccc1[N+](=O)[O-] ZINC000611336860 1045283849 /nfs/dbraw/zinc/28/38/49/1045283849.db2.gz ZZDWSQWWDYJUBB-IAQYHMDHSA-N 1 1 332.787 4.341 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000611515616 1045320391 /nfs/dbraw/zinc/32/03/91/1045320391.db2.gz HCRBTJQTRCRNFZ-UZLBHIALSA-N 1 1 340.423 4.428 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2nc(-c3ccccc3)c[nH]2)cc1[N+](=O)[O-] ZINC000194354930 1045723991 /nfs/dbraw/zinc/72/39/91/1045723991.db2.gz ZMAVIHKGPDXRTO-CQSZACIVSA-N 1 1 336.395 4.144 20 5 EIBDMO C[N@@H+](Cc1nnc2n1CCC2)Cc1c2ccccc2cc2ccccc21 ZINC000768223277 1045758248 /nfs/dbraw/zinc/75/82/48/1045758248.db2.gz HQQUBCSZHDGYKW-UHFFFAOYSA-N 1 1 342.446 4.163 20 5 EIBDMO C[N@H+](Cc1nnc2n1CCC2)Cc1c2ccccc2cc2ccccc21 ZINC000768223277 1045758233 /nfs/dbraw/zinc/75/82/33/1045758233.db2.gz HQQUBCSZHDGYKW-UHFFFAOYSA-N 1 1 342.446 4.163 20 5 EIBDMO Cc1cc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cnc1Cl ZINC000768336028 1045788539 /nfs/dbraw/zinc/78/85/39/1045788539.db2.gz GBWUXNPBHUOEIF-UHFFFAOYSA-N 1 1 331.803 4.116 20 5 EIBDMO Cc1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cnc1Cl ZINC000768336028 1045788557 /nfs/dbraw/zinc/78/85/57/1045788557.db2.gz GBWUXNPBHUOEIF-UHFFFAOYSA-N 1 1 331.803 4.116 20 5 EIBDMO CCC[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C[C@@H]1CCCCO1 ZINC000768541561 1045817779 /nfs/dbraw/zinc/81/77/79/1045817779.db2.gz IXWYFZKKELBCNG-AWEZNQCLSA-N 1 1 326.824 4.029 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)ccc1Cl ZINC000768542152 1045818008 /nfs/dbraw/zinc/81/80/08/1045818008.db2.gz NRRWZYQLFPMQFI-MRXNPFEDSA-N 1 1 332.787 4.291 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)ccc1Cl ZINC000768542152 1045818012 /nfs/dbraw/zinc/81/80/12/1045818012.db2.gz NRRWZYQLFPMQFI-MRXNPFEDSA-N 1 1 332.787 4.291 20 5 EIBDMO NC(=O)CC[C@H]1CCC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000769187985 1045890565 /nfs/dbraw/zinc/89/05/65/1045890565.db2.gz DCYQWKXZPILQOS-QGZVFWFLSA-N 1 1 346.474 4.471 20 5 EIBDMO COc1ccc(C[C@H](C)[N@H+]2CCc3ccccc3[C@@H]2C)c([N+](=O)[O-])c1 ZINC001170327243 1046000054 /nfs/dbraw/zinc/00/00/54/1046000054.db2.gz GILACEBAQFNVAX-GJZGRUSLSA-N 1 1 340.423 4.154 20 5 EIBDMO CC[N@@H+](Cc1ccc(F)cc1)[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170353451 1046011764 /nfs/dbraw/zinc/01/17/64/1046011764.db2.gz YJIJSHSLAQIZEJ-AWEZNQCLSA-N 1 1 346.402 4.196 20 5 EIBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC001170348040 1046022980 /nfs/dbraw/zinc/02/29/80/1046022980.db2.gz VGIUJLFQDJMDKK-BEFAXECRSA-N 1 1 340.423 4.372 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)c(N2CCC[C@H](c3[nH]cc[nH+]3)C2)c(Cl)c1 ZINC000772039702 1046551120 /nfs/dbraw/zinc/55/11/20/1046551120.db2.gz QOHHJAWIKGUZBB-VIFPVBQESA-N 1 1 341.198 4.009 20 5 EIBDMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000536669400 1046618204 /nfs/dbraw/zinc/61/82/04/1046618204.db2.gz BBCSBTCDRCCQQG-WFASDCNBSA-N 1 1 331.441 4.339 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3C[C@@H]4CCCC[C@@H]4C3)cs2)c1 ZINC000536667821 1046646300 /nfs/dbraw/zinc/64/63/00/1046646300.db2.gz DZNQKYCRWCSVLP-GASCZTMLSA-N 1 1 343.452 4.340 20 5 EIBDMO CC[C@H](C)[N@H+](Cc1ccccc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000917454459 1046895899 /nfs/dbraw/zinc/89/58/99/1046895899.db2.gz IBRSGZQYSDCDMZ-HNNXBMFYSA-N 1 1 338.411 4.203 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+](Cc1cccc(O)c1)CC1CC1 ZINC000746664140 1046958949 /nfs/dbraw/zinc/95/89/49/1046958949.db2.gz XTSGNQQQASRAFR-UHFFFAOYSA-N 1 1 346.814 4.366 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+](Cc1cccc(O)c1)CC1CC1 ZINC000746664140 1046958928 /nfs/dbraw/zinc/95/89/28/1046958928.db2.gz XTSGNQQQASRAFR-UHFFFAOYSA-N 1 1 346.814 4.366 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000746667106 1046977724 /nfs/dbraw/zinc/97/77/24/1046977724.db2.gz XANUSNJYEJPVNH-GOSISDBHSA-N 1 1 346.814 4.212 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000746667106 1046977709 /nfs/dbraw/zinc/97/77/09/1046977709.db2.gz XANUSNJYEJPVNH-GOSISDBHSA-N 1 1 346.814 4.212 20 5 EIBDMO CC1(C)[C@H](C(F)(F)F)CC[N@@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000787322503 1046992443 /nfs/dbraw/zinc/99/24/43/1046992443.db2.gz QTHLXKJTUWRILK-GFCCVEGCSA-N 1 1 336.741 4.411 20 5 EIBDMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000787322503 1046992485 /nfs/dbraw/zinc/99/24/85/1046992485.db2.gz QTHLXKJTUWRILK-GFCCVEGCSA-N 1 1 336.741 4.411 20 5 EIBDMO CC[C@@H](c1ccccc1)[C@@H]1CCC[N@H+]1Cn1nc(C)c([N+](=O)[O-])c1C ZINC000746713915 1047067036 /nfs/dbraw/zinc/06/70/36/1047067036.db2.gz YEFZBLUHBBERQE-ROUUACIJSA-N 1 1 342.443 4.024 20 5 EIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@@H]1Cc1ccc(F)cc1 ZINC000917831927 1047159093 /nfs/dbraw/zinc/15/90/93/1047159093.db2.gz VGUSJMKORAUPDD-QGZVFWFLSA-N 1 1 332.350 4.080 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2Cc2cccc(F)c2)cc1F ZINC000788475621 1047199478 /nfs/dbraw/zinc/19/94/78/1047199478.db2.gz HBNIFFQVNPUCMN-MRXNPFEDSA-N 1 1 332.350 4.080 20 5 EIBDMO C[C@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788507478 1047208845 /nfs/dbraw/zinc/20/88/45/1047208845.db2.gz QQPUXGMWYSLCDJ-DJJJIMSYSA-N 1 1 337.379 4.210 20 5 EIBDMO C[C@@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788507477 1047210648 /nfs/dbraw/zinc/21/06/48/1047210648.db2.gz QQPUXGMWYSLCDJ-BFUOFWGJSA-N 1 1 337.379 4.210 20 5 EIBDMO C[C@H](N[C@@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000556132942 1047485295 /nfs/dbraw/zinc/48/52/95/1047485295.db2.gz UWVFVPMGONKCTR-VPWXQRGCSA-N 1 1 339.439 4.081 20 5 EIBDMO C[C@H]([NH2+][C@@H]1CCN(C)[C@H](c2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000556132942 1047485302 /nfs/dbraw/zinc/48/53/02/1047485302.db2.gz UWVFVPMGONKCTR-VPWXQRGCSA-N 1 1 339.439 4.081 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3ccc4c(c3)COC4)C2)cc1 ZINC000824820818 1047964733 /nfs/dbraw/zinc/96/47/33/1047964733.db2.gz OBCWIZGWJAPHKD-KRWDZBQOSA-N 1 1 338.407 4.005 20 5 EIBDMO Cc1cc(C)c(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])cn1 ZINC000825221334 1048052062 /nfs/dbraw/zinc/05/20/62/1048052062.db2.gz IWMWYVHVPVVEOY-UHFFFAOYSA-N 1 1 340.210 4.203 20 5 EIBDMO CC[C@H](O)[C@H]1CCCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809948109 1048577353 /nfs/dbraw/zinc/57/73/53/1048577353.db2.gz UGJLFPQHPADDIN-KGLIPLIRSA-N 1 1 347.242 4.027 20 5 EIBDMO CC[C@H](O)[C@H]1CCCC[N@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809948109 1048577371 /nfs/dbraw/zinc/57/73/71/1048577371.db2.gz UGJLFPQHPADDIN-KGLIPLIRSA-N 1 1 347.242 4.027 20 5 EIBDMO Cc1ccncc1[C@@H](C)[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809974519 1048585074 /nfs/dbraw/zinc/58/50/74/1048585074.db2.gz BHNWVUVGDHSKCE-SNVBAGLBSA-N 1 1 340.210 4.456 20 5 EIBDMO O=[N+]([O-])c1cc(CNc2cc(C3CC3)cc[nH+]2)ccc1Br ZINC000810175387 1048668893 /nfs/dbraw/zinc/66/88/93/1048668893.db2.gz JNCDPFHWRBXZIC-UHFFFAOYSA-N 1 1 348.200 4.242 20 5 EIBDMO O=[N+]([O-])c1ccc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC000301226738 1048727457 /nfs/dbraw/zinc/72/74/57/1048727457.db2.gz BZUDLWDKHLOVSZ-CTXDPNEZSA-N 1 1 337.423 4.202 20 5 EIBDMO CC1(C)[C@@H](c2ccccc2)CC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001171266617 1049003797 /nfs/dbraw/zinc/00/37/97/1049003797.db2.gz IUFTXCIKZHACQU-LJQANCHMSA-N 1 1 340.423 4.242 20 5 EIBDMO Cc1c([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)cccc1[N+](=O)[O-] ZINC000773037284 1049542853 /nfs/dbraw/zinc/54/28/53/1049542853.db2.gz SDUIOYAOLZAVGT-NSHDSACASA-N 1 1 349.774 4.316 20 5 EIBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000812882193 1049620539 /nfs/dbraw/zinc/62/05/39/1049620539.db2.gz MTNNRCZDUCGEBQ-YPMHNXCESA-N 1 1 334.313 4.287 20 5 EIBDMO C[C@@H](CSc1ccccc1)[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC001171772412 1049793507 /nfs/dbraw/zinc/79/35/07/1049793507.db2.gz MZXDBCNGXNYUTP-ZDUSSCGKSA-N 1 1 334.416 4.347 20 5 EIBDMO CCOc1cc(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)ccc1[N+](=O)[O-] ZINC000617210279 1049967491 /nfs/dbraw/zinc/96/74/91/1049967491.db2.gz IGWWMBQHCOMKCW-QGZVFWFLSA-N 1 1 342.395 4.036 20 5 EIBDMO Cc1ccccc1C[N@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089882767 1050143496 /nfs/dbraw/zinc/14/34/96/1050143496.db2.gz MBAVWROXEHIBNU-UHFFFAOYSA-N 1 1 337.379 4.190 20 5 EIBDMO Cc1ccccc1C[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089882767 1050143499 /nfs/dbraw/zinc/14/34/99/1050143499.db2.gz MBAVWROXEHIBNU-UHFFFAOYSA-N 1 1 337.379 4.190 20 5 EIBDMO CC(C)C[N@H+]1CC[C@H](CNc2c(Cl)cc([N+](=O)[O-])cc2Cl)C1 ZINC001185793845 1050160952 /nfs/dbraw/zinc/16/09/52/1050160952.db2.gz VJSNKEBKVYYCBA-LLVKDONJSA-N 1 1 346.258 4.291 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1NC[C@H]1CCC[N@H+]1C1CCCCC1 ZINC001186285232 1050282699 /nfs/dbraw/zinc/28/26/99/1050282699.db2.gz OWCVXGOFGDKVLE-OAHLLOKOSA-N 1 1 337.851 4.457 20 5 EIBDMO CCC[N@@H+](CC(C)C)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173194285 1050340779 /nfs/dbraw/zinc/34/07/79/1050340779.db2.gz ZBZDBLYARUTQNH-CYBMUJFWSA-N 1 1 326.412 4.042 20 5 EIBDMO COc1ccccc1[C@@H]1CCC[N@H+]1[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173228386 1050356937 /nfs/dbraw/zinc/35/69/37/1050356937.db2.gz VUBKVNUUGZEYHH-KXBFYZLASA-N 1 1 340.423 4.372 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](Oc2ccccc2)C1 ZINC001173224951 1050357126 /nfs/dbraw/zinc/35/71/26/1050357126.db2.gz AASMJKPGVIJDIZ-OXQOHEQNSA-N 1 1 340.423 4.069 20 5 EIBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173231865 1050359297 /nfs/dbraw/zinc/35/92/97/1050359297.db2.gz OEOCZKLIINSKNS-HZPDHXFCSA-N 1 1 342.439 4.097 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccc(Cl)cc2C1 ZINC001173230702 1050360449 /nfs/dbraw/zinc/36/04/49/1050360449.db2.gz ZNZPZJDNXVLHDL-CYBMUJFWSA-N 1 1 330.815 4.238 20 5 EIBDMO CC[N@@H+](Cc1ccc(OC)cc1)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173230729 1050360589 /nfs/dbraw/zinc/36/05/89/1050360589.db2.gz FAAFRKUKPWGCBO-OAHLLOKOSA-N 1 1 328.412 4.057 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C(C)(C)Cc1ccccc1 ZINC001173233820 1050362041 /nfs/dbraw/zinc/36/20/41/1050362041.db2.gz ZFJIDAUKLNTIOH-INIZCTEOSA-N 1 1 326.440 4.479 20 5 EIBDMO CCCC[N@@H+](C)C[C@@H](C)Nc1c(Cl)c(Cl)ccc1[N+](=O)[O-] ZINC001186612619 1050369373 /nfs/dbraw/zinc/36/93/73/1050369373.db2.gz RTEIEFFHLCGDFK-SNVBAGLBSA-N 1 1 334.247 4.434 20 5 EIBDMO CC(C)c1ccc(C[NH+]2CCN(c3sccc3[N+](=O)[O-])CC2)cc1 ZINC001186602985 1050375696 /nfs/dbraw/zinc/37/56/96/1050375696.db2.gz XVIWGOCDOQPGSU-UHFFFAOYSA-N 1 1 345.468 4.102 20 5 EIBDMO C[C@@H]1CN(c2ccccc2[N+](=O)[O-])[C@H](C)[C@H](C)[N@H+]1Cc1ccccc1 ZINC001186906717 1050446350 /nfs/dbraw/zinc/44/63/50/1050446350.db2.gz VTAFWAZYUPOADS-IXDOHACOSA-N 1 1 339.439 4.083 20 5 EIBDMO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000775142155 1050613241 /nfs/dbraw/zinc/61/32/41/1050613241.db2.gz DDLDKTATDILYQG-JTQLQIEISA-N 1 1 338.766 4.247 20 5 EIBDMO CC(C)(C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1)Oc1ccccc1 ZINC001179909618 1050831674 /nfs/dbraw/zinc/83/16/74/1050831674.db2.gz PZVPYQSGUIOULN-UHFFFAOYSA-N 1 1 340.423 4.417 20 5 EIBDMO Cc1ccccc1[C@H]1CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001190407495 1051176816 /nfs/dbraw/zinc/17/68/16/1051176816.db2.gz OSLJRJKNLRCUFA-LJQANCHMSA-N 1 1 326.396 4.119 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](CCc1ccccc1)C(C)C ZINC001190582513 1051226728 /nfs/dbraw/zinc/22/67/28/1051226728.db2.gz YPWXNUCNMPOMMN-UHFFFAOYSA-N 1 1 328.412 4.057 20 5 EIBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H](c3ccccc3)CC2)c1 ZINC001190781756 1051277398 /nfs/dbraw/zinc/27/73/98/1051277398.db2.gz XVYIXJYZNAFCDT-SFHVURJKSA-N 1 1 340.423 4.243 20 5 EIBDMO C[C@H](c1cccnc1)[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000183724895 1051328759 /nfs/dbraw/zinc/32/87/59/1051328759.db2.gz HSYKIVKDHMKKCP-CQSZACIVSA-N 1 1 337.379 4.443 20 5 EIBDMO C[C@@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccco2)C1 ZINC001191212860 1051386416 /nfs/dbraw/zinc/38/64/16/1051386416.db2.gz DAAMLNLHMNCYKF-CRAIPNDOSA-N 1 1 344.411 4.430 20 5 EIBDMO COc1ccc(C[N@H+]2CCc3ccccc3[C@@H]2C(C)C)cc1[N+](=O)[O-] ZINC001191542208 1051480256 /nfs/dbraw/zinc/48/02/56/1051480256.db2.gz YWFUKOMDXHUAOT-FQEVSTJZSA-N 1 1 340.423 4.359 20 5 EIBDMO COc1ccc(OCC[N@@H+](C(C)C)C2CCCCC2)c([N+](=O)[O-])c1 ZINC001191871809 1051575357 /nfs/dbraw/zinc/57/53/57/1051575357.db2.gz WSEZAGGNYKEGRD-UHFFFAOYSA-N 1 1 336.432 4.025 20 5 EIBDMO Cc1csc([C@H]2CC[N@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC001175946757 1051863908 /nfs/dbraw/zinc/86/39/08/1051863908.db2.gz LWKJQKPKVZFUAQ-KBPBESRZSA-N 1 1 331.441 4.219 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@@H]3CCC[C@]3(C(F)(F)F)C2)c(Cl)c1 ZINC001176193263 1051937831 /nfs/dbraw/zinc/93/78/31/1051937831.db2.gz OTMKIENXVDOTFX-FZMZJTMJSA-N 1 1 348.752 4.413 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@@H]3CCC[C@]3(C(F)(F)F)C2)c(Cl)c1 ZINC001176193263 1051937841 /nfs/dbraw/zinc/93/78/41/1051937841.db2.gz OTMKIENXVDOTFX-FZMZJTMJSA-N 1 1 348.752 4.413 20 5 EIBDMO Cc1nc(Nc2ccc([NH+]3CCCCCC3)cc2)ccc1[N+](=O)[O-] ZINC001184644123 1052068924 /nfs/dbraw/zinc/06/89/24/1052068924.db2.gz IUDBSWDEWAJQQT-UHFFFAOYSA-N 1 1 326.400 4.422 20 5 EIBDMO Cc1ccc([C@@H]2CC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)c(C)c1 ZINC001194074097 1052071242 /nfs/dbraw/zinc/07/12/42/1052071242.db2.gz PUEHIRSEPFXVRU-QGZVFWFLSA-N 1 1 340.423 4.080 20 5 EIBDMO C[C@H]1CCCC[N@H+]1CCCCNc1cc(Cl)ccc1[N+](=O)[O-] ZINC001184874572 1052122922 /nfs/dbraw/zinc/12/29/22/1052122922.db2.gz QYWBLHHSYKYBQL-ZDUSSCGKSA-N 1 1 325.840 4.315 20 5 EIBDMO CC[C@@H](C)[C@H](C)[N@@H+]1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC001194291474 1052129549 /nfs/dbraw/zinc/12/95/49/1052129549.db2.gz OVNPKYOWMATUPV-MNOVXSKESA-N 1 1 341.249 4.150 20 5 EIBDMO CC[C@@H](C)[C@H](C)[N@H+]1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC001194291474 1052129553 /nfs/dbraw/zinc/12/95/53/1052129553.db2.gz OVNPKYOWMATUPV-MNOVXSKESA-N 1 1 341.249 4.150 20 5 EIBDMO CCCC[N@H+]1CCCC[C@@H]1CNc1ncc([N+](=O)[O-])c2ccccc21 ZINC001185097681 1052165848 /nfs/dbraw/zinc/16/58/48/1052165848.db2.gz BBVIPTTYLKXHEC-OAHLLOKOSA-N 1 1 342.443 4.210 20 5 EIBDMO CC(C)[N@H+](Cc1ccc(F)cc1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774831966 1052180863 /nfs/dbraw/zinc/18/08/63/1052180863.db2.gz GVOTUJMCZIDHLY-UHFFFAOYSA-N 1 1 347.346 4.053 20 5 EIBDMO CC(C)[N@@H+](Cc1ccc(F)cc1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774831966 1052180868 /nfs/dbraw/zinc/18/08/68/1052180868.db2.gz GVOTUJMCZIDHLY-UHFFFAOYSA-N 1 1 347.346 4.053 20 5 EIBDMO Cc1[nH+]ccn1CCCCNc1c(Cl)c(Cl)ccc1[N+](=O)[O-] ZINC001185477905 1052248858 /nfs/dbraw/zinc/24/88/58/1052248858.db2.gz JJKGXRTUBMIMDM-UHFFFAOYSA-N 1 1 343.214 4.299 20 5 EIBDMO CC[N@@H+](C[C@@H](O)c1ccc(C)cc1)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000764285654 1053051819 /nfs/dbraw/zinc/05/18/19/1053051819.db2.gz YJKOQLKNTFYXJV-DNVCBOLYSA-N 1 1 328.412 4.020 20 5 EIBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@H]1CCC[C@@H]1c1ccccc1 ZINC001195022848 1053229799 /nfs/dbraw/zinc/22/97/99/1053229799.db2.gz OSSXOIYDHYKVFU-MSOLQXFVSA-N 1 1 340.423 4.242 20 5 EIBDMO CC(C)[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H](C)c1ccccc1 ZINC000794684111 1053262769 /nfs/dbraw/zinc/26/27/69/1053262769.db2.gz LJAJMNXZKOQRFI-DNVCBOLYSA-N 1 1 328.412 4.100 20 5 EIBDMO CC(C)[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H](C)c1ccccc1 ZINC000794684115 1053264992 /nfs/dbraw/zinc/26/49/92/1053264992.db2.gz LJAJMNXZKOQRFI-KXBFYZLASA-N 1 1 328.412 4.100 20 5 EIBDMO CC(C)[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H](C)c1ccccc1 ZINC000794684109 1053265748 /nfs/dbraw/zinc/26/57/48/1053265748.db2.gz LJAJMNXZKOQRFI-BEFAXECRSA-N 1 1 328.412 4.100 20 5 EIBDMO Cc1cc(F)ccc1[C@@H]1CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001195122247 1053278373 /nfs/dbraw/zinc/27/83/73/1053278373.db2.gz FMNCTGWBTGJHTE-IBGZPJMESA-N 1 1 344.386 4.258 20 5 EIBDMO CCCCCC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC001195546546 1053432271 /nfs/dbraw/zinc/43/22/71/1053432271.db2.gz GGMHEBHMUYWFFS-IYARVYRRSA-N 1 1 334.460 4.281 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2)CCc2ccc(Cl)cc21 ZINC001195765877 1053474774 /nfs/dbraw/zinc/47/47/74/1053474774.db2.gz AEDBPEFLWFHYON-CYBMUJFWSA-N 1 1 330.815 4.410 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC([C@@H]2CCCCO2)CC1 ZINC000852594371 1053593253 /nfs/dbraw/zinc/59/32/53/1053593253.db2.gz MHOJPTYYTOSMHO-KRWDZBQOSA-N 1 1 338.835 4.029 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]([C@@H]3CCCCO3)C2)ccc1Cl ZINC000852595552 1053594263 /nfs/dbraw/zinc/59/42/63/1053594263.db2.gz IGDIZJNUDQEIIM-YOEHRIQHSA-N 1 1 338.835 4.029 20 5 EIBDMO CCCCC[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001196329686 1053639339 /nfs/dbraw/zinc/63/93/39/1053639339.db2.gz PFKBUYIVFNSFAZ-OAHLLOKOSA-N 1 1 335.404 4.438 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCCC[C@@H]2C[C@H](O)c2ccco2)cc1 ZINC000121901479 1053855680 /nfs/dbraw/zinc/85/56/80/1053855680.db2.gz YUBGZGJTXZEFQW-MSOLQXFVSA-N 1 1 344.411 4.056 20 5 EIBDMO CC1(C)CC[N@@H+](Cc2cc([O-])ccc2[N+](=O)[O-])C[C@@H]1c1ccccc1 ZINC001198201620 1054092569 /nfs/dbraw/zinc/09/25/69/1054092569.db2.gz ANDSGQWVOBHPBE-GOSISDBHSA-N 1 1 340.423 4.316 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1/C=C/c1ccccc1 ZINC001198271603 1054121006 /nfs/dbraw/zinc/12/10/06/1054121006.db2.gz XFYSQXINYZDZFB-QZEKMECESA-N 1 1 338.407 4.281 20 5 EIBDMO CN(C)c1ccc(C2CC[NH+](Cc3csc([N+](=O)[O-])c3)CC2)cc1 ZINC000775880749 1054203438 /nfs/dbraw/zinc/20/34/38/1054203438.db2.gz NDSJLAGIMNOWKI-UHFFFAOYSA-N 1 1 345.468 4.102 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc(OC(F)F)cc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872018401 1054331210 /nfs/dbraw/zinc/33/12/10/1054331210.db2.gz LMQILEALMXTSAA-SNVBAGLBSA-N 1 1 340.301 4.186 20 5 EIBDMO CCOCc1ccc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872022793 1054336734 /nfs/dbraw/zinc/33/67/34/1054336734.db2.gz ZVRXEJBQUKVYHO-ZDUSSCGKSA-N 1 1 332.375 4.121 20 5 EIBDMO Cc1csc([C@@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)n1 ZINC000877814253 1055128561 /nfs/dbraw/zinc/12/85/61/1055128561.db2.gz WPWFOJWKEPNUPR-LLVKDONJSA-N 1 1 337.832 4.003 20 5 EIBDMO Cc1ccc2sc(C[NH2+][C@H](C)c3cccc([N+](=O)[O-])c3)nc2c1 ZINC001168604614 1055205567 /nfs/dbraw/zinc/20/55/67/1055205567.db2.gz QASWEJVANBJTKI-GFCCVEGCSA-N 1 1 327.409 4.364 20 5 EIBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273252912 1055566385 /nfs/dbraw/zinc/56/63/85/1055566385.db2.gz AJALDVBIYHJLNO-RTBURBONSA-N 1 1 344.386 4.086 20 5 EIBDMO CCCc1ccc(CNc2ccc([N+](=O)[O-])c3c2CC[N@H+](C)C3)cc1 ZINC001168635917 1055807609 /nfs/dbraw/zinc/80/76/09/1055807609.db2.gz PYRKCEJJESWWFP-UHFFFAOYSA-N 1 1 339.439 4.147 20 5 EIBDMO CCCc1ccc(CNc2ccc([N+](=O)[O-])c3c2CC[N@@H+](C)C3)cc1 ZINC001168635917 1055807611 /nfs/dbraw/zinc/80/76/11/1055807611.db2.gz PYRKCEJJESWWFP-UHFFFAOYSA-N 1 1 339.439 4.147 20 5 EIBDMO Cc1[nH+]ccn1-c1ccccc1CNc1cc(C)c([N+](=O)[O-])cc1F ZINC000338719474 1056528523 /nfs/dbraw/zinc/52/85/23/1056528523.db2.gz WQVOTTBUXWENGO-UHFFFAOYSA-N 1 1 340.358 4.149 20 5 EIBDMO C[C@@H]1C[C@@H](c2ccccc2F)[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000743856137 1059162089 /nfs/dbraw/zinc/16/20/89/1059162089.db2.gz HDDDYOOHGIJFES-XIKOKIGWSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@@H]1C[C@@H](c2ccccc2F)[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000743856137 1059162121 /nfs/dbraw/zinc/16/21/21/1059162121.db2.gz HDDDYOOHGIJFES-XIKOKIGWSA-N 1 1 332.350 4.456 20 5 EIBDMO CC[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@@H](O)c1ccc(C)cc1 ZINC000743865202 1059179432 /nfs/dbraw/zinc/17/94/32/1059179432.db2.gz YOXBBDQOXMDRHV-GOSISDBHSA-N 1 1 348.830 4.112 20 5 EIBDMO C[N@@H+](Cc1ccc(Oc2ccccc2)cc1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169037069 1060593299 /nfs/dbraw/zinc/59/32/99/1060593299.db2.gz IOWGFBKHAGBIPW-ROUUACIJSA-N 1 1 340.423 4.356 20 5 EIBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@@H](c3ccc(Cl)c(Cl)c3)C2)C1 ZINC001169036387 1060594086 /nfs/dbraw/zinc/59/40/86/1060594086.db2.gz OANHWEMVBLKEPF-BNOWGMLFSA-N 1 1 343.254 4.228 20 5 EIBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[NH+]2CCCCC2)cc1OC ZINC001169451098 1060820636 /nfs/dbraw/zinc/82/06/36/1060820636.db2.gz DVBDOPOACONJSG-CQSZACIVSA-N 1 1 336.432 4.014 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccnc3ccccc23)C2CC2)cc1 ZINC000536638029 1032241780 /nfs/dbraw/zinc/24/17/80/1032241780.db2.gz NZSAZTSBCZPKNU-UHFFFAOYSA-N 1 1 333.391 4.308 20 5 EIBDMO CC[C@H](C)[C@@H](C)[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CC1 ZINC000532963256 1032416285 /nfs/dbraw/zinc/41/62/85/1032416285.db2.gz BKXFERBNNMMWJQ-QWHCGFSZSA-N 1 1 344.415 4.044 20 5 EIBDMO C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000475742976 1032554576 /nfs/dbraw/zinc/55/45/76/1032554576.db2.gz VNJIWMRBVHCOEJ-RDBSUJKOSA-N 1 1 329.400 4.116 20 5 EIBDMO COc1cccc(C2([NH2+]Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)c1 ZINC000510079562 1019161552 /nfs/dbraw/zinc/16/15/52/1019161552.db2.gz RRUGHQXJRTWKFU-UHFFFAOYSA-N 1 1 332.787 4.036 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1c1ccc(C)s1 ZINC000430206280 1019310931 /nfs/dbraw/zinc/31/09/31/1019310931.db2.gz KMAKXGGQDBRQDZ-HNNXBMFYSA-N 1 1 332.425 4.310 20 5 EIBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CCCC12CCOCC2 ZINC001167186279 1020501494 /nfs/dbraw/zinc/50/14/94/1020501494.db2.gz CUXMRTLRVZORBI-GOSISDBHSA-N 1 1 346.471 4.402 20 5 EIBDMO C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1cccc(OC(F)(F)F)c1 ZINC000175754767 1020835339 /nfs/dbraw/zinc/83/53/39/1020835339.db2.gz ZQQMKIQPWBNNEF-VIFPVBQESA-N 1 1 346.330 4.406 20 5 EIBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc(N(C)C)c1 ZINC000610368019 1021538188 /nfs/dbraw/zinc/53/81/88/1021538188.db2.gz FEZOLGFPRULGLA-UHFFFAOYSA-N 1 1 327.428 4.071 20 5 EIBDMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000610091399 1021833694 /nfs/dbraw/zinc/83/36/94/1021833694.db2.gz QJKSUWDVIURUTR-CJNGLKHVSA-N 1 1 344.415 4.045 20 5 EIBDMO Cc1ccc(C[C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC001167387213 1021927672 /nfs/dbraw/zinc/92/76/72/1021927672.db2.gz QLDSBYVVBJYRQG-QGZVFWFLSA-N 1 1 328.387 4.249 20 5 EIBDMO Cc1ccc(C[C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC001167387212 1021929710 /nfs/dbraw/zinc/92/97/10/1021929710.db2.gz QLDSBYVVBJYRQG-KRWDZBQOSA-N 1 1 328.387 4.249 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000181579968 1022452571 /nfs/dbraw/zinc/45/25/71/1022452571.db2.gz YEBDTZDNYCJKDI-SECBINFHSA-N 1 1 326.730 4.377 20 5 EIBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CC=CCC1 ZINC000541315498 1022699030 /nfs/dbraw/zinc/69/90/30/1022699030.db2.gz CKUROJLUXSSQOS-HNNXBMFYSA-N 1 1 341.411 4.080 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1nc(C3CC3)cs1)CCCC2 ZINC000417307334 1023256342 /nfs/dbraw/zinc/25/63/42/1023256342.db2.gz FYMDMMVQBIGSNK-MRXNPFEDSA-N 1 1 343.452 4.486 20 5 EIBDMO CCc1nc(C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)cs1 ZINC000417314327 1023259368 /nfs/dbraw/zinc/25/93/68/1023259368.db2.gz QWTHYMMUIBXKNX-INIZCTEOSA-N 1 1 331.441 4.171 20 5 EIBDMO Cc1csc(C2([NH2+]Cc3ccc([N+](=O)[O-])c(F)c3)CCCC2)n1 ZINC000276362272 1023373430 /nfs/dbraw/zinc/37/34/30/1023373430.db2.gz ZAVHPKLRZFLFSQ-UHFFFAOYSA-N 1 1 335.404 4.058 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CC[C@H](COc2ccccc2)C1 ZINC000780371258 1023458572 /nfs/dbraw/zinc/45/85/72/1023458572.db2.gz QSKGICOHOAWTGO-AWEZNQCLSA-N 1 1 346.814 4.149 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CC[C@H](COc2ccccc2)C1 ZINC000780371258 1023458578 /nfs/dbraw/zinc/45/85/78/1023458578.db2.gz QSKGICOHOAWTGO-AWEZNQCLSA-N 1 1 346.814 4.149 20 5 EIBDMO COCCCC[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000418131687 1023557829 /nfs/dbraw/zinc/55/78/29/1023557829.db2.gz ICGIYFWYXVSQPE-UHFFFAOYSA-N 1 1 334.441 4.182 20 5 EIBDMO CCC[C@@H]1[C@H](C)CCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000072776089 1023845249 /nfs/dbraw/zinc/84/52/49/1023845249.db2.gz JZISCOJRGMEVCL-CZUORRHYSA-N 1 1 344.415 4.045 20 5 EIBDMO CC1CCC([N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C2CC2)CC1 ZINC000610581305 1024116753 /nfs/dbraw/zinc/11/67/53/1024116753.db2.gz VVJJJGUEKIMLSR-UHFFFAOYSA-N 1 1 329.400 4.279 20 5 EIBDMO Cc1ccccc1C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CC1 ZINC000610580930 1024117802 /nfs/dbraw/zinc/11/78/02/1024117802.db2.gz CRUHMLCUNWTCOJ-UHFFFAOYSA-N 1 1 337.379 4.209 20 5 EIBDMO Cc1ccccc1C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CC1 ZINC000610580930 1024117824 /nfs/dbraw/zinc/11/78/24/1024117824.db2.gz CRUHMLCUNWTCOJ-UHFFFAOYSA-N 1 1 337.379 4.209 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCO[C@H]3CCC[C@H]32)s1 ZINC000430884014 1024181318 /nfs/dbraw/zinc/18/13/18/1024181318.db2.gz UCGRGWOYENGMPK-SJORKVTESA-N 1 1 344.436 4.077 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCO[C@H]3CCC[C@H]32)s1 ZINC000430884014 1024181333 /nfs/dbraw/zinc/18/13/33/1024181333.db2.gz UCGRGWOYENGMPK-SJORKVTESA-N 1 1 344.436 4.077 20 5 EIBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1nc2ccccc2n1C(F)F ZINC000548403450 1024254006 /nfs/dbraw/zinc/25/40/06/1024254006.db2.gz NBRGSJLTAFMOPG-NSHDSACASA-N 1 1 346.337 4.190 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1nc2ccccc2n1C(F)F ZINC000548403449 1024254156 /nfs/dbraw/zinc/25/41/56/1024254156.db2.gz NBRGSJLTAFMOPG-LLVKDONJSA-N 1 1 346.337 4.190 20 5 EIBDMO COc1ccc(C[NH2+]Cc2csc(Cl)c2Cl)cc1[N+](=O)[O-] ZINC000432239760 1024717148 /nfs/dbraw/zinc/71/71/48/1024717148.db2.gz GGFQFNLHSKDWEV-UHFFFAOYSA-N 1 1 347.223 4.262 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+]Cc2nc3ccccc3nc2C)cc1[N+](=O)[O-] ZINC000181826060 1024835143 /nfs/dbraw/zinc/83/51/43/1024835143.db2.gz MURORMFZQPNDPE-ZDUSSCGKSA-N 1 1 336.395 4.006 20 5 EIBDMO O=[N+]([O-])c1c(F)cccc1NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000065201985 1025150092 /nfs/dbraw/zinc/15/00/92/1025150092.db2.gz ZHNJFJXSRKYTGX-INIZCTEOSA-N 1 1 343.402 4.058 20 5 EIBDMO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000611561493 1025387190 /nfs/dbraw/zinc/38/71/90/1025387190.db2.gz RMIUHHFUJDGHHO-LJXYTEIVSA-N 1 1 328.334 4.271 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C(F)(F)F)cn2)cc1[N+](=O)[O-] ZINC000278902233 1025390094 /nfs/dbraw/zinc/39/00/94/1025390094.db2.gz VIBCNSHMVLCGBV-LLVKDONJSA-N 1 1 339.317 4.168 20 5 EIBDMO CC[N@@H+](C[C@@H](O)c1ccc(C)cc1)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC001167517884 1025899664 /nfs/dbraw/zinc/89/96/64/1025899664.db2.gz SKVSTZQXNXJRSJ-OXJNMPFZSA-N 1 1 342.439 4.328 20 5 EIBDMO CC(C)Oc1ccccc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511071262 1026120549 /nfs/dbraw/zinc/12/05/49/1026120549.db2.gz BTQCBEQPIAVXFE-UHFFFAOYSA-N 1 1 328.412 4.057 20 5 EIBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1nc(C(C)(C)C)cs1 ZINC000511072966 1026126528 /nfs/dbraw/zinc/12/65/28/1026126528.db2.gz HPUMYBXNSFXSLV-UHFFFAOYSA-N 1 1 333.457 4.023 20 5 EIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1nc(C(C)(C)C)cs1 ZINC000511072966 1026126550 /nfs/dbraw/zinc/12/65/50/1026126550.db2.gz HPUMYBXNSFXSLV-UHFFFAOYSA-N 1 1 333.457 4.023 20 5 EIBDMO CC(C)C[N@@H+](Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)C1CCCC1 ZINC000728899210 1026282388 /nfs/dbraw/zinc/28/23/88/1026282388.db2.gz DAJCARJPRQULCF-UHFFFAOYSA-N 1 1 342.443 4.316 20 5 EIBDMO CCc1nc2c(s1)[C@@H]([N@@H+](C)CCc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000478051893 1026340332 /nfs/dbraw/zinc/34/03/32/1026340332.db2.gz FCFDRABIKUMSAT-INIZCTEOSA-N 1 1 345.468 4.166 20 5 EIBDMO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc2O1 ZINC000894690047 1026341505 /nfs/dbraw/zinc/34/15/05/1026341505.db2.gz PWIBBEURMUAIFM-IAQYHMDHSA-N 1 1 332.787 4.250 20 5 EIBDMO C[C@H]1CCCCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000512204280 1026460477 /nfs/dbraw/zinc/46/04/77/1026460477.db2.gz UTQRVIAHMYDMHI-AWEZNQCLSA-N 1 1 329.400 4.057 20 5 EIBDMO CC[N@@H+](Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])[C@H](C)C(C)C ZINC000512221222 1026502176 /nfs/dbraw/zinc/50/21/76/1026502176.db2.gz WZWYFNCNMFMCQG-LLVKDONJSA-N 1 1 346.374 4.071 20 5 EIBDMO C[N@H+](Cc1cccc(OC(F)(F)F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000507117123 1026648831 /nfs/dbraw/zinc/64/88/31/1026648831.db2.gz SLLQBEPTKLUEFT-UHFFFAOYSA-N 1 1 340.301 4.125 20 5 EIBDMO C[N@@H+](Cc1cccc(OC(F)(F)F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000507117123 1026648838 /nfs/dbraw/zinc/64/88/38/1026648838.db2.gz SLLQBEPTKLUEFT-UHFFFAOYSA-N 1 1 340.301 4.125 20 5 EIBDMO CCOc1ccc([C@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000015372216 1026712557 /nfs/dbraw/zinc/71/25/57/1026712557.db2.gz PHRXAEFYODUNTE-LJQANCHMSA-N 1 1 326.396 4.331 20 5 EIBDMO CC[C@H]1C[C@]1([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1cccc(C)c1 ZINC000500507082 1026806531 /nfs/dbraw/zinc/80/65/31/1026806531.db2.gz HIROHHCRWBJJAB-HNAYVOBHSA-N 1 1 328.387 4.457 20 5 EIBDMO C[C@H]([NH2+][C@@H](CN1CCCC1)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000178642295 1026971572 /nfs/dbraw/zinc/97/15/72/1026971572.db2.gz FBVWDCRFHBAJAG-JXFKEZNVSA-N 1 1 339.439 4.083 20 5 EIBDMO C[C@H]([NH2+][C@H](CN1CCCC1)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000178642335 1026976889 /nfs/dbraw/zinc/97/68/89/1026976889.db2.gz FBVWDCRFHBAJAG-OXJNMPFZSA-N 1 1 339.439 4.083 20 5 EIBDMO CC(C)[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccccc1F ZINC000519908748 1027039096 /nfs/dbraw/zinc/03/90/96/1027039096.db2.gz NKAOWJRXXVPIEA-UHFFFAOYSA-N 1 1 332.375 4.023 20 5 EIBDMO COC(=O)c1cc([C@@H](C)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)oc1C ZINC000292389264 1027662905 /nfs/dbraw/zinc/66/29/05/1027662905.db2.gz HZLDWKQKZQIZAR-VXGBXAGGSA-N 1 1 346.383 4.003 20 5 EIBDMO COC(=O)c1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)oc1C ZINC000292389254 1027676814 /nfs/dbraw/zinc/67/68/14/1027676814.db2.gz HZLDWKQKZQIZAR-NWDGAFQWSA-N 1 1 346.383 4.003 20 5 EIBDMO COc1ccc(OC)c([C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000078991252 1027787466 /nfs/dbraw/zinc/78/74/66/1027787466.db2.gz BDIGCJATYZHNLB-OLZOCXBDSA-N 1 1 330.384 4.024 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](CCCSCc1ccccc1)CC2 ZINC001167647250 1027839673 /nfs/dbraw/zinc/83/96/73/1027839673.db2.gz LDJXFGYPXSXFET-UHFFFAOYSA-N 1 1 342.464 4.276 20 5 EIBDMO CC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H]1CCCC[C@H]1C ZINC000444674943 1027955550 /nfs/dbraw/zinc/95/55/50/1027955550.db2.gz KZNCXFNLAAKULX-CJNGLKHVSA-N 1 1 344.415 4.045 20 5 EIBDMO COCc1ccc([C@@H]2CCC[N@@H+]2[C@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000248619034 1028620283 /nfs/dbraw/zinc/62/02/83/1028620283.db2.gz LULVYIKVEXGXGS-DYVFJYSZSA-N 1 1 330.384 4.232 20 5 EIBDMO COCc1ccc([C@@H]2CCC[N@H+]2[C@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000248619034 1028620288 /nfs/dbraw/zinc/62/02/88/1028620288.db2.gz LULVYIKVEXGXGS-DYVFJYSZSA-N 1 1 330.384 4.232 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@H](Cc2ccccc2)C1 ZINC000525126684 1029467003 /nfs/dbraw/zinc/46/70/03/1029467003.db2.gz JMFCNNVBMFPOMT-OAHLLOKOSA-N 1 1 330.815 4.313 20 5 EIBDMO CCCc1nc(C)c(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)o1 ZINC000428453318 1029582101 /nfs/dbraw/zinc/58/21/01/1029582101.db2.gz GDJAVJWPESTBTI-UHFFFAOYSA-N 1 1 331.416 4.254 20 5 EIBDMO CCCc1nc(C)c(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)o1 ZINC000428453318 1029582111 /nfs/dbraw/zinc/58/21/11/1029582111.db2.gz GDJAVJWPESTBTI-UHFFFAOYSA-N 1 1 331.416 4.254 20 5 EIBDMO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@@H+](C)Cc1cc(C(C)(C)C)n[nH]1 ZINC000447083308 1029682022 /nfs/dbraw/zinc/68/20/22/1029682022.db2.gz AQOMAFPXGWVINZ-ZROIWOOFSA-N 1 1 342.443 4.151 20 5 EIBDMO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1cc(C(C)(C)C)n[nH]1 ZINC000447083308 1029682024 /nfs/dbraw/zinc/68/20/24/1029682024.db2.gz AQOMAFPXGWVINZ-ZROIWOOFSA-N 1 1 342.443 4.151 20 5 EIBDMO C[N@H+](CCC(F)(F)F)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000092478803 1029913575 /nfs/dbraw/zinc/91/35/75/1029913575.db2.gz HPQCSQSYEMSPQL-UHFFFAOYSA-N 1 1 328.290 4.239 20 5 EIBDMO C[N@@H+](CCC(F)(F)F)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000092478803 1029913603 /nfs/dbraw/zinc/91/36/03/1029913603.db2.gz HPQCSQSYEMSPQL-UHFFFAOYSA-N 1 1 328.290 4.239 20 5 EIBDMO CC(C)(C)c1cnc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000451551315 1030572399 /nfs/dbraw/zinc/57/23/99/1030572399.db2.gz UGGAARUDCVRSEW-OAHLLOKOSA-N 1 1 343.427 4.260 20 5 EIBDMO CC(C)(C)c1cnc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000451551315 1030572401 /nfs/dbraw/zinc/57/24/01/1030572401.db2.gz UGGAARUDCVRSEW-OAHLLOKOSA-N 1 1 343.427 4.260 20 5 EIBDMO CC(C)c1ccc(C[N@H+]2CC[C@@H](Cc3ccncc3)C2)cc1[N+](=O)[O-] ZINC000611983753 1030678932 /nfs/dbraw/zinc/67/89/32/1030678932.db2.gz GFKOEBJITGRZDY-SFHVURJKSA-N 1 1 339.439 4.178 20 5 EIBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@@H]1C ZINC000449493559 1031788594 /nfs/dbraw/zinc/78/85/94/1031788594.db2.gz FCEZFZBTXWDNNO-SUMWQHHRSA-N 1 1 346.452 4.180 20 5 EIBDMO CCO[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C ZINC000449495020 1031804295 /nfs/dbraw/zinc/80/42/95/1031804295.db2.gz NTKLNKXAQTXCNX-KDOFPFPSSA-N 1 1 344.411 4.102 20 5 EIBDMO C[C@H]1CCCC[N@@H+]1CCC1CCN(Cc2ccccc2[N+](=O)[O-])CC1 ZINC000531909983 1031807067 /nfs/dbraw/zinc/80/70/67/1031807067.db2.gz CWLOHXOILHMNFD-KRWDZBQOSA-N 1 1 345.487 4.071 20 5 EIBDMO C[C@H]1CCCC[N@H+]1CCC1CCN(Cc2ccccc2[N+](=O)[O-])CC1 ZINC000531909983 1031807074 /nfs/dbraw/zinc/80/70/74/1031807074.db2.gz CWLOHXOILHMNFD-KRWDZBQOSA-N 1 1 345.487 4.071 20 5 EIBDMO CCO[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H]1C ZINC000449504077 1031812019 /nfs/dbraw/zinc/81/20/19/1031812019.db2.gz YHONJTLLMREVCT-KDOFPFPSSA-N 1 1 344.411 4.102 20 5 EIBDMO CCO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H]1C ZINC000449504076 1031813072 /nfs/dbraw/zinc/81/30/72/1031813072.db2.gz YHONJTLLMREVCT-KBXCAEBGSA-N 1 1 344.411 4.102 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H]1CCc2cc(F)c(F)c(F)c21 ZINC000449590767 1031863795 /nfs/dbraw/zinc/86/37/95/1031863795.db2.gz VSTZLSAGMPECHA-CQSZACIVSA-N 1 1 336.313 4.098 20 5 EIBDMO COC[C@@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000449778387 1032003805 /nfs/dbraw/zinc/00/38/05/1032003805.db2.gz RZXPYVKGGGCJLQ-OAHLLOKOSA-N 1 1 344.411 4.103 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](CC(=O)OC(C)(C)C)C1 ZINC000532127304 1032054569 /nfs/dbraw/zinc/05/45/69/1032054569.db2.gz RYFAFPJRDBJDHZ-CABCVRRESA-N 1 1 348.443 4.100 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](CC(=O)OC(C)(C)C)C1 ZINC000532124862 1032055367 /nfs/dbraw/zinc/05/53/67/1032055367.db2.gz KEFIRLAXHQPQCY-HUUCEWRRSA-N 1 1 348.443 4.100 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](CC(=O)OC(C)(C)C)C1 ZINC000532124861 1032055851 /nfs/dbraw/zinc/05/58/51/1032055851.db2.gz KEFIRLAXHQPQCY-GJZGRUSLSA-N 1 1 348.443 4.100 20 5 EIBDMO Cc1csc([C@@H](C)[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)n1 ZINC000433169660 1033974034 /nfs/dbraw/zinc/97/40/34/1033974034.db2.gz YBOMYEYUXVCOSC-ABAIWWIYSA-N 1 1 331.441 4.433 20 5 EIBDMO Cc1cc([C@H]2CCC[N@H+]2Cc2ccc(C(C)C)c([N+](=O)[O-])c2)on1 ZINC000509818482 1034049185 /nfs/dbraw/zinc/04/91/85/1034049185.db2.gz HQCJAPMWMVMUJA-MRXNPFEDSA-N 1 1 329.400 4.352 20 5 EIBDMO Cc1cc([C@H]2CCC[N@@H+]2Cc2ccc(C(C)C)c([N+](=O)[O-])c2)on1 ZINC000509818482 1034049199 /nfs/dbraw/zinc/04/91/99/1034049199.db2.gz HQCJAPMWMVMUJA-MRXNPFEDSA-N 1 1 329.400 4.352 20 5 EIBDMO C[C@H]1C[C@@H](c2ccccc2)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000513235865 1034852029 /nfs/dbraw/zinc/85/20/29/1034852029.db2.gz GFUTXUNPUANJQK-UGSOOPFHSA-N 1 1 336.395 4.054 20 5 EIBDMO C[C@H]1C[C@@H](c2ccccc2)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000513235865 1034852037 /nfs/dbraw/zinc/85/20/37/1034852037.db2.gz GFUTXUNPUANJQK-UGSOOPFHSA-N 1 1 336.395 4.054 20 5 EIBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000513479526 1034980480 /nfs/dbraw/zinc/98/04/80/1034980480.db2.gz NGHQYBGJZHLMKB-JXMNSVBMSA-N 1 1 340.423 4.180 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1COc2c1ccc(C)c2C ZINC000595013051 1035505875 /nfs/dbraw/zinc/50/58/75/1035505875.db2.gz GJEJKSUSJSIQAE-CXAGYDPISA-N 1 1 342.395 4.005 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](C)c1ccc(F)cc1F ZINC000595007644 1035530563 /nfs/dbraw/zinc/53/05/63/1035530563.db2.gz PGVIJGPOKPTTIX-WDEREUQCSA-N 1 1 336.338 4.293 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)c1ccc(F)cc1F ZINC000595007642 1035533001 /nfs/dbraw/zinc/53/30/01/1035533001.db2.gz PGVIJGPOKPTTIX-MNOVXSKESA-N 1 1 336.338 4.293 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccc(Cl)cc1F ZINC000595033886 1035562547 /nfs/dbraw/zinc/56/25/47/1035562547.db2.gz RUZITXPGSBLYJU-JTQLQIEISA-N 1 1 338.766 4.247 20 5 EIBDMO Cc1noc(C[N@H+](C)[C@@H](C)[C@H](C)c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000595334486 1035631031 /nfs/dbraw/zinc/63/10/31/1035631031.db2.gz QYBHFRFVRBCKES-JQWIXIFHSA-N 1 1 337.807 4.169 20 5 EIBDMO CCc1nc2c(s1)[C@H]([N@H+](C)Cc1ccc(F)cc1[N+](=O)[O-])CCC2 ZINC000595382001 1035668608 /nfs/dbraw/zinc/66/86/08/1035668608.db2.gz AWVBIDCPNVMTRT-CQSZACIVSA-N 1 1 349.431 4.262 20 5 EIBDMO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-])CCC2 ZINC000595382001 1035668613 /nfs/dbraw/zinc/66/86/13/1035668613.db2.gz AWVBIDCPNVMTRT-CQSZACIVSA-N 1 1 349.431 4.262 20 5 EIBDMO Cc1noc(C[NH2+][C@H](CC(C)C)c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000595418002 1035672269 /nfs/dbraw/zinc/67/22/69/1035672269.db2.gz NDBPLPLSBXAUQE-CQSZACIVSA-N 1 1 337.807 4.422 20 5 EIBDMO C[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1ccccc1OC(F)F ZINC000595409197 1035674389 /nfs/dbraw/zinc/67/43/89/1035674389.db2.gz BDVYEBTYTTUCOS-JTQLQIEISA-N 1 1 340.301 4.186 20 5 EIBDMO Cc1noc(C[N@H+]2C[C@H](c3ccccc3)[C@H]3CCCC[C@@H]32)c1[N+](=O)[O-] ZINC000595450222 1035682016 /nfs/dbraw/zinc/68/20/16/1035682016.db2.gz SFKNCUZVQMTHAE-ZACQAIPSSA-N 1 1 341.411 4.049 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H]2O[C@H](c3ccccc3)C[C@@H]21 ZINC000593126958 1035806370 /nfs/dbraw/zinc/80/63/70/1035806370.db2.gz ZILWSZYXROZQNG-UFYCRDLUSA-N 1 1 338.407 4.089 20 5 EIBDMO COc1cc(C[N@H+](C)[C@H](C)c2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000485769194 1036254207 /nfs/dbraw/zinc/25/42/07/1036254207.db2.gz GHOMGPIRDLXXEL-LLVKDONJSA-N 1 1 336.338 4.075 20 5 EIBDMO COc1cc(C[N@@H+](C)[C@H](C)c2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000485769194 1036254225 /nfs/dbraw/zinc/25/42/25/1036254225.db2.gz GHOMGPIRDLXXEL-LLVKDONJSA-N 1 1 336.338 4.075 20 5 EIBDMO CC[C@H]1C[C@@]1([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1cccc(C)c1 ZINC000502564761 1036359303 /nfs/dbraw/zinc/35/93/03/1036359303.db2.gz ILMPNHKVLIXCGC-LIRRHRJNSA-N 1 1 328.387 4.457 20 5 EIBDMO CC(C)c1cccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000602613918 1036516159 /nfs/dbraw/zinc/51/61/59/1036516159.db2.gz ASQOXLRQTKDKBD-UHFFFAOYSA-N 1 1 325.368 4.149 20 5 EIBDMO CSC1CC[NH+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000602724298 1036594451 /nfs/dbraw/zinc/59/44/51/1036594451.db2.gz CQGNVUQVSBJKAU-UHFFFAOYSA-N 1 1 349.481 4.046 20 5 EIBDMO C[C@@H](C[N@@H+](C)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)(C)C ZINC000603057006 1036714603 /nfs/dbraw/zinc/71/46/03/1036714603.db2.gz YBAOMPHPVZFQBZ-STQMWFEESA-N 1 1 346.431 4.320 20 5 EIBDMO CC(C)c1ccc(CNCCC[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000061029117 1036783829 /nfs/dbraw/zinc/78/38/29/1036783829.db2.gz RKOVFCZSRSVLKV-INIZCTEOSA-N 1 1 333.476 4.072 20 5 EIBDMO Cc1noc(C)c1[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000590172032 1037010496 /nfs/dbraw/zinc/01/04/96/1037010496.db2.gz ZDILRADZCZYFHI-QMMMGPOBSA-N 1 1 343.305 4.069 20 5 EIBDMO COc1ccc(C[N@@H+](C)[C@H](C)c2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000603856760 1037049361 /nfs/dbraw/zinc/04/93/61/1037049361.db2.gz WAOMLFPAABPTLP-GFCCVEGCSA-N 1 1 334.803 4.450 20 5 EIBDMO C[C@H](c1ccccc1Cl)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000603856673 1037049658 /nfs/dbraw/zinc/04/96/58/1037049658.db2.gz RLJLMGSFTIQSCN-CYBMUJFWSA-N 1 1 334.803 4.320 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H](c1ccccn1)C1CCC1 ZINC000599573670 1037082021 /nfs/dbraw/zinc/08/20/21/1037082021.db2.gz KIQFEQUCLLBKIV-QGZVFWFLSA-N 1 1 331.803 4.274 20 5 EIBDMO COc1ccc([C@H](C)[N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000604012472 1037146695 /nfs/dbraw/zinc/14/66/95/1037146695.db2.gz GSAKFUQQESTIBX-HNNXBMFYSA-N 1 1 344.411 4.065 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(Cl)c(F)c2)c(Cl)c1 ZINC000183807057 1037272792 /nfs/dbraw/zinc/27/27/92/1037272792.db2.gz AXXADNXXUAOZIK-UHFFFAOYSA-N 1 1 329.158 4.331 20 5 EIBDMO C[C@@H]1C[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)Cc2ccccc21 ZINC000760807642 1037290299 /nfs/dbraw/zinc/29/02/99/1037290299.db2.gz GVXYNIYHAPQNRY-CQSZACIVSA-N 1 1 349.390 4.369 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)Cc2ccccc21 ZINC000760807642 1037290319 /nfs/dbraw/zinc/29/03/19/1037290319.db2.gz GVXYNIYHAPQNRY-CQSZACIVSA-N 1 1 349.390 4.369 20 5 EIBDMO C[N@H+](Cc1csc([N+](=O)[O-])c1)C[C@H]1CCCO[C@H]1c1ccccc1 ZINC000604521434 1037398235 /nfs/dbraw/zinc/39/82/35/1037398235.db2.gz JVDCBKYWVGOWGK-AEFFLSMTSA-N 1 1 346.452 4.256 20 5 EIBDMO C[N@H+](Cc1ccc(Br)s1)Cc1cccc([N+](=O)[O-])c1 ZINC000061800711 1037557563 /nfs/dbraw/zinc/55/75/63/1037557563.db2.gz WEFWUELMWYVGMJ-UHFFFAOYSA-N 1 1 341.230 4.051 20 5 EIBDMO C[N@@H+](Cc1ccc(Br)s1)Cc1cccc([N+](=O)[O-])c1 ZINC000061800711 1037557580 /nfs/dbraw/zinc/55/75/80/1037557580.db2.gz WEFWUELMWYVGMJ-UHFFFAOYSA-N 1 1 341.230 4.051 20 5 EIBDMO COc1ccccc1C1([NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000592393103 1037782939 /nfs/dbraw/zinc/78/29/39/1037782939.db2.gz DGEPVJPAEOVXMQ-CQSZACIVSA-N 1 1 326.396 4.252 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cc(-c3ccccc3)no2)C2CC2)c1 ZINC000490052095 1038324803 /nfs/dbraw/zinc/32/48/03/1038324803.db2.gz YHIDNPGJMBLCGZ-UHFFFAOYSA-N 1 1 349.390 4.414 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cc(-c3ccccc3)no2)C2CC2)c1 ZINC000490052095 1038324812 /nfs/dbraw/zinc/32/48/12/1038324812.db2.gz 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CCc1ccc([C@H](COC)[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)o1 ZINC000192899578 1039847450 /nfs/dbraw/zinc/84/74/50/1039847450.db2.gz ZOCZUQKNDJGBNZ-MSOLQXFVSA-N 1 1 344.411 4.105 20 5 EIBDMO C[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000159413601 1039972582 /nfs/dbraw/zinc/97/25/82/1039972582.db2.gz AKTJWFMVRUUKIB-UHFFFAOYSA-N 1 1 327.222 4.122 20 5 EIBDMO CCc1nc2c(s1)[C@@H]([N@H+](C)Cc1ccccc1[N+](=O)[O-])CCC2 ZINC000152615128 1040117204 /nfs/dbraw/zinc/11/72/04/1040117204.db2.gz NWZRUHWZOPOTJQ-HNNXBMFYSA-N 1 1 331.441 4.123 20 5 EIBDMO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ccccc1[N+](=O)[O-])CCC2 ZINC000152615128 1040117241 /nfs/dbraw/zinc/11/72/41/1040117241.db2.gz NWZRUHWZOPOTJQ-HNNXBMFYSA-N 1 1 331.441 4.123 20 5 EIBDMO COc1cccc(Cl)c1C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000515106946 1040488661 /nfs/dbraw/zinc/48/86/61/1040488661.db2.gz GGLLAPGIEJPABN-LBPRGKRZSA-N 1 1 334.803 4.416 20 5 EIBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@H](C)C1 ZINC000443065985 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COc1cc(C[N@@H+](C)[C@H]2CCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000540902171 1041725999 /nfs/dbraw/zinc/72/59/99/1041725999.db2.gz YHAZTHLSSQZVOA-KRWDZBQOSA-N 1 1 326.396 4.113 20 5 EIBDMO COc1cccc2c1CC[N@@H+]([C@@H](C)c1cc([N+](=O)[O-])ccc1C)C2 ZINC000541084256 1041805285 /nfs/dbraw/zinc/80/52/85/1041805285.db2.gz NDCFGKDIQIIZSB-AWEZNQCLSA-N 1 1 326.396 4.031 20 5 EIBDMO COc1cccc2c1CC[N@H+]([C@@H](C)c1cc([N+](=O)[O-])ccc1C)C2 ZINC000541084256 1041805287 /nfs/dbraw/zinc/80/52/87/1041805287.db2.gz NDCFGKDIQIIZSB-AWEZNQCLSA-N 1 1 326.396 4.031 20 5 EIBDMO CCC[C@H]1[C@H](C)CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000464731337 1042135559 /nfs/dbraw/zinc/13/55/59/1042135559.db2.gz FDWZAXAMDAQFBP-CJNGLKHVSA-N 1 1 344.415 4.045 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH+]2CCC3(C=Cc4ccccc4O3)CC2)cs1 ZINC000595880000 1042168198 /nfs/dbraw/zinc/16/81/98/1042168198.db2.gz XUOSMSTWKHHCCM-UHFFFAOYSA-N 1 1 342.420 4.097 20 5 EIBDMO CCC[C@]1(C)CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000464843251 1042193380 /nfs/dbraw/zinc/19/33/80/1042193380.db2.gz RULSDUGUFJVZRX-GOSISDBHSA-N 1 1 344.415 4.047 20 5 EIBDMO CC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@H](C)c1cccc(O)c1 ZINC000509554946 1042363793 /nfs/dbraw/zinc/36/37/93/1042363793.db2.gz HYRFGWYQTAKLEN-YYRKOSNBSA-N 1 1 326.396 4.397 20 5 EIBDMO CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@H](C)c1ccc(F)cc1 ZINC000518472988 1042539632 /nfs/dbraw/zinc/53/96/32/1042539632.db2.gz DNPUMXFNTZBCOY-CQSZACIVSA-N 1 1 332.375 4.196 20 5 EIBDMO CC(C)Cc1ncc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])s1 ZINC000492192412 1042574986 /nfs/dbraw/zinc/57/49/86/1042574986.db2.gz GFHQBESQRUIJJQ-UHFFFAOYSA-N 1 1 333.457 4.275 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](Cc1cccc(F)c1)C(C)C ZINC000518597181 1042582417 /nfs/dbraw/zinc/58/24/17/1042582417.db2.gz NBYOMNWHQFJKAP-UHFFFAOYSA-N 1 1 332.375 4.153 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](Cc1cccc(F)c1)C(C)C ZINC000518597181 1042582423 /nfs/dbraw/zinc/58/24/23/1042582423.db2.gz NBYOMNWHQFJKAP-UHFFFAOYSA-N 1 1 332.375 4.153 20 5 EIBDMO CCOc1cc(C[N@H+](C)[C@H](C)c2ccccc2F)ccc1[N+](=O)[O-] ZINC000492359291 1042624064 /nfs/dbraw/zinc/62/40/64/1042624064.db2.gz WLLWEQSBZCQUMF-CYBMUJFWSA-N 1 1 332.375 4.326 20 5 EIBDMO CCOc1cc(C[N@@H+](C)[C@H](C)c2ccccc2F)ccc1[N+](=O)[O-] ZINC000492359291 1042624071 /nfs/dbraw/zinc/62/40/71/1042624071.db2.gz WLLWEQSBZCQUMF-CYBMUJFWSA-N 1 1 332.375 4.326 20 5 EIBDMO CC(C)CC[N@@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000506585403 1042639452 /nfs/dbraw/zinc/63/94/52/1042639452.db2.gz YBURDBQDMHRBBS-UHFFFAOYSA-N 1 1 342.443 4.006 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCCOCc1ccccc1 ZINC000439474083 1042646240 /nfs/dbraw/zinc/64/62/40/1042646240.db2.gz MYBKBXCWDQKEQU-INIZCTEOSA-N 1 1 328.412 4.195 20 5 EIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](Cc1cccs1)C1CC1 ZINC000506614140 1042688533 /nfs/dbraw/zinc/68/85/33/1042688533.db2.gz UNQRBCHAONNJQY-UHFFFAOYSA-N 1 1 332.425 4.220 20 5 EIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](Cc1cccs1)C1CC1 ZINC000506614140 1042688539 /nfs/dbraw/zinc/68/85/39/1042688539.db2.gz UNQRBCHAONNJQY-UHFFFAOYSA-N 1 1 332.425 4.220 20 5 EIBDMO CCOc1cc(C[N@H+](C)[C@H](C)c2sc(C)nc2C)ccc1[N+](=O)[O-] ZINC000492626972 1042713330 /nfs/dbraw/zinc/71/33/30/1042713330.db2.gz BXBXNEOFJDAWDH-GFCCVEGCSA-N 1 1 349.456 4.260 20 5 EIBDMO CCOc1cc(C[N@@H+](C)[C@H](C)c2sc(C)nc2C)ccc1[N+](=O)[O-] ZINC000492626972 1042713335 /nfs/dbraw/zinc/71/33/35/1042713335.db2.gz BXBXNEOFJDAWDH-GFCCVEGCSA-N 1 1 349.456 4.260 20 5 EIBDMO C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C1(C)CCCC1 ZINC000426532949 1042808308 /nfs/dbraw/zinc/80/83/08/1042808308.db2.gz NBSQNAZTSFQZHT-UHFFFAOYSA-N 1 1 331.441 4.483 20 5 EIBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])c(Cl)c3)C2)cc1 ZINC000761507838 1042872132 /nfs/dbraw/zinc/87/21/32/1042872132.db2.gz YRWDVUZWPCCZOO-OAHLLOKOSA-N 1 1 346.814 4.246 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](Nc3ccccc3)C2)cc1Cl ZINC000761515952 1042874363 /nfs/dbraw/zinc/87/43/63/1042874363.db2.gz XTZTVRMTYWAOIM-MRXNPFEDSA-N 1 1 345.830 4.325 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](Nc3ccccc3)C2)cc1Cl ZINC000761515952 1042874367 /nfs/dbraw/zinc/87/43/67/1042874367.db2.gz XTZTVRMTYWAOIM-MRXNPFEDSA-N 1 1 345.830 4.325 20 5 EIBDMO C[C@H](Cc1ccc(O)cc1)[N@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493340342 1042899039 /nfs/dbraw/zinc/89/90/39/1042899039.db2.gz VUQWYQVNFDNVKA-GFCCVEGCSA-N 1 1 334.803 4.017 20 5 EIBDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493340342 1042899040 /nfs/dbraw/zinc/89/90/40/1042899040.db2.gz VUQWYQVNFDNVKA-GFCCVEGCSA-N 1 1 334.803 4.017 20 5 EIBDMO COc1ccc([C@H]2CC[N@@H+](Cc3c(Cl)cccc3[N+](=O)[O-])C2)cc1 ZINC000493505590 1042921373 /nfs/dbraw/zinc/92/13/73/1042921373.db2.gz XSHJGGPLOVCICI-AWEZNQCLSA-N 1 1 346.814 4.246 20 5 EIBDMO C[C@H]1C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC(C)(C)C1 ZINC000543171530 1044034831 /nfs/dbraw/zinc/03/48/31/1044034831.db2.gz GDZMEDIFOZDTGL-CYBMUJFWSA-N 1 1 329.400 4.118 20 5 EIBDMO CCCO[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000116279343 1044157533 /nfs/dbraw/zinc/15/75/33/1044157533.db2.gz AAOVCSYJJVIHOO-OAHLLOKOSA-N 1 1 326.824 4.029 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH+]2C3CCCC2CCC3)ccc1Br ZINC000707160987 1044809301 /nfs/dbraw/zinc/80/93/01/1044809301.db2.gz GUGRQJXYVOFKND-UHFFFAOYSA-N 1 1 339.233 4.264 20 5 EIBDMO CC[C@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1cccc([N+](=O)[O-])c1 ZINC000154822583 1044839548 /nfs/dbraw/zinc/83/95/48/1044839548.db2.gz HQFZNGWIGXJQGT-SFHVURJKSA-N 1 1 337.379 4.491 20 5 EIBDMO CCC[C@H]([NH2+][C@@H](COC)c1ccc(C)o1)c1cccc([N+](=O)[O-])c1 ZINC000156453207 1045057725 /nfs/dbraw/zinc/05/77/25/1045057725.db2.gz UZQMAOCAXUIHQU-IRXDYDNUSA-N 1 1 332.400 4.315 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H](c4ccco4)C3)o2)cc1 ZINC000611271269 1045270562 /nfs/dbraw/zinc/27/05/62/1045270562.db2.gz GBQKKWVBQJCFAW-OAHLLOKOSA-N 1 1 338.363 4.437 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+][C@H]2COc3c2cccc3Cl)cc1[N+](=O)[O-] ZINC000611336162 1045281710 /nfs/dbraw/zinc/28/17/10/1045281710.db2.gz XHZFVDYQQVMOJU-ABAIWWIYSA-N 1 1 332.787 4.341 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1COc2c1cccc2Cl ZINC000611336820 1045282731 /nfs/dbraw/zinc/28/27/31/1045282731.db2.gz NFCROYSIHGOFHC-BZNIZROVSA-N 1 1 332.787 4.341 20 5 EIBDMO Cc1cc(C)cc([C@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000611392849 1045299721 /nfs/dbraw/zinc/29/97/21/1045299721.db2.gz PPNPGJXJALWKEZ-ZDUSSCGKSA-N 1 1 325.368 4.204 20 5 EIBDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1OC ZINC000611515137 1045320937 /nfs/dbraw/zinc/32/09/37/1045320937.db2.gz PRVKODXBHADGQL-AWEZNQCLSA-N 1 1 344.411 4.113 20 5 EIBDMO Cc1c([C@@H](C)[NH2+]Cc2ccn(C3CCCC3)n2)cccc1[N+](=O)[O-] ZINC000090547101 1045333159 /nfs/dbraw/zinc/33/31/59/1045333159.db2.gz QOGNKBNQYPCBSX-CQSZACIVSA-N 1 1 328.416 4.066 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000609233600 1045699422 /nfs/dbraw/zinc/69/94/22/1045699422.db2.gz GSPJKJVQTHZASV-HNAYVOBHSA-N 1 1 326.396 4.119 20 5 EIBDMO CC[C@H]([NH2+]Cc1nc(-c2ccccc2)c[nH]1)c1cccc([N+](=O)[O-])c1 ZINC000194354852 1045723337 /nfs/dbraw/zinc/72/33/37/1045723337.db2.gz WVUJZKDRWZVJQO-KRWDZBQOSA-N 1 1 336.395 4.226 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](Nc3ccccc3)C2)ccc1Cl ZINC000768557992 1045820362 /nfs/dbraw/zinc/82/03/62/1045820362.db2.gz YFXIZMDRXUIIQC-MRXNPFEDSA-N 1 1 345.830 4.325 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](Nc3ccccc3)C2)ccc1Cl ZINC000768557992 1045820365 /nfs/dbraw/zinc/82/03/65/1045820365.db2.gz YFXIZMDRXUIIQC-MRXNPFEDSA-N 1 1 345.830 4.325 20 5 EIBDMO CO[C@@]1(C(F)(F)F)CCC[N@@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000614923795 1045943159 /nfs/dbraw/zinc/94/31/59/1045943159.db2.gz FQEZPOUUSOYVQN-WFASDCNBSA-N 1 1 346.349 4.008 20 5 EIBDMO CO[C@@]1(C(F)(F)F)CCC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000614923795 1045943173 /nfs/dbraw/zinc/94/31/73/1045943173.db2.gz FQEZPOUUSOYVQN-WFASDCNBSA-N 1 1 346.349 4.008 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cc2ccccc2o1 ZINC000792880554 1046091029 /nfs/dbraw/zinc/09/10/29/1046091029.db2.gz SMJAGDPATNEKPA-LLVKDONJSA-N 1 1 341.323 4.100 20 5 EIBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)[C@@H](c1ccccc1)N(C)C ZINC000769930534 1046113755 /nfs/dbraw/zinc/11/37/55/1046113755.db2.gz LDXZCTXEBQBGAP-ACJLOTCBSA-N 1 1 347.846 4.029 20 5 EIBDMO Cc1[nH+]ccn1-c1ccc(CNc2c(C)cccc2[N+](=O)[O-])cc1F ZINC000301197915 1046585349 /nfs/dbraw/zinc/58/53/49/1046585349.db2.gz VBDJFAOKJSKYTJ-UHFFFAOYSA-N 1 1 340.358 4.149 20 5 EIBDMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000787416909 1047003802 /nfs/dbraw/zinc/00/38/02/1047003802.db2.gz LPGFOOHVDXWQNU-GFCCVEGCSA-N 1 1 336.741 4.411 20 5 EIBDMO CC1(C)[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000787416909 1047003785 /nfs/dbraw/zinc/00/37/85/1047003785.db2.gz LPGFOOHVDXWQNU-GFCCVEGCSA-N 1 1 336.741 4.411 20 5 EIBDMO COc1ccc(C[N@@H+](C)C/C(C)=C\c2cccc([N+](=O)[O-])c2)cc1F ZINC000787405869 1047006891 /nfs/dbraw/zinc/00/68/91/1047006891.db2.gz FVJKTSKHSCXBPA-ZROIWOOFSA-N 1 1 344.386 4.278 20 5 EIBDMO C[C@H]1C[C@@H](c2cccnc2)[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000788463354 1047194161 /nfs/dbraw/zinc/19/41/61/1047194161.db2.gz STDCCJBQWUKIGC-LRDDRELGSA-N 1 1 331.803 4.226 20 5 EIBDMO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000788463354 1047194174 /nfs/dbraw/zinc/19/41/74/1047194174.db2.gz STDCCJBQWUKIGC-LRDDRELGSA-N 1 1 331.803 4.226 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC000609280605 1047486012 /nfs/dbraw/zinc/48/60/12/1047486012.db2.gz FWYBFWISSGIWEU-INIZCTEOSA-N 1 1 328.387 4.189 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCCOc2c(Cl)cccc21 ZINC000089512213 1047779104 /nfs/dbraw/zinc/77/91/04/1047779104.db2.gz ZTBJHHQXSUMHEJ-OAHLLOKOSA-N 1 1 332.787 4.252 20 5 EIBDMO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC(COc2ccccc2)CC1 ZINC000919807037 1048085653 /nfs/dbraw/zinc/08/56/53/1048085653.db2.gz NHNXXSNKJHGVNC-UHFFFAOYSA-N 1 1 344.386 4.025 20 5 EIBDMO COc1cccc2cc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])oc21 ZINC000809688874 1048478830 /nfs/dbraw/zinc/47/88/30/1048478830.db2.gz QLOFJZXYOTVSOK-UHFFFAOYSA-N 1 1 340.379 4.024 20 5 EIBDMO CCOC[C@H]1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000809946508 1048571159 /nfs/dbraw/zinc/57/11/59/1048571159.db2.gz WTLGILGJUVZCLO-NSHDSACASA-N 1 1 347.242 4.150 20 5 EIBDMO CCOC[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000809946508 1048571173 /nfs/dbraw/zinc/57/11/73/1048571173.db2.gz WTLGILGJUVZCLO-NSHDSACASA-N 1 1 347.242 4.150 20 5 EIBDMO C[C@H]([NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])c1cccnc1 ZINC000809970508 1048575038 /nfs/dbraw/zinc/57/50/38/1048575038.db2.gz BIFWEBINMQFDCR-VIFPVBQESA-N 1 1 326.183 4.147 20 5 EIBDMO CSC[C@@H]1CCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809955265 1048582587 /nfs/dbraw/zinc/58/25/87/1048582587.db2.gz UAZUTYFPFKAKFK-NSHDSACASA-N 1 1 335.256 4.229 20 5 EIBDMO CSC[C@@H]1CCC[N@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809955265 1048582601 /nfs/dbraw/zinc/58/26/01/1048582601.db2.gz UAZUTYFPFKAKFK-NSHDSACASA-N 1 1 335.256 4.229 20 5 EIBDMO Cc1c(C[N@H+]2CC[C@@H](Oc3ccc(Cl)cc3)C2)cccc1[N+](=O)[O-] ZINC001170593411 1048593583 /nfs/dbraw/zinc/59/35/83/1048593583.db2.gz LHPBSAZCFYCEBH-QGZVFWFLSA-N 1 1 346.814 4.210 20 5 EIBDMO Cc1c(C[N@H+]2CCS[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000609800594 1049327691 /nfs/dbraw/zinc/32/76/91/1049327691.db2.gz PGBBGMSCEXHMAH-SFHVURJKSA-N 1 1 328.437 4.193 20 5 EIBDMO COc1ccc2oc(C[NH2+]Cc3cc([N+](=O)[O-])ccc3Cl)cc2c1 ZINC000763487891 1050023976 /nfs/dbraw/zinc/02/39/76/1050023976.db2.gz XTASEJKVSWXHOB-UHFFFAOYSA-N 1 1 346.770 4.293 20 5 EIBDMO C[N@@H+](CCc1ccccc1F)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172913704 1050231884 /nfs/dbraw/zinc/23/18/84/1050231884.db2.gz UKEDVAYUXDVAHY-GOSISDBHSA-N 1 1 342.414 4.156 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CC[C@@H](c3ccccc3)C1)CC2 ZINC001172909590 1050245396 /nfs/dbraw/zinc/24/53/96/1050245396.db2.gz TYMRMBWNTLAFGW-UXHICEINSA-N 1 1 336.435 4.332 20 5 EIBDMO CCC[N@H+]([C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-])[C@@H](C)CC ZINC001173184198 1050338025 /nfs/dbraw/zinc/33/80/25/1050338025.db2.gz LWMPVTJAJRFYLD-QWHCGFSZSA-N 1 1 326.412 4.184 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC001173227222 1050356483 /nfs/dbraw/zinc/35/64/83/1050356483.db2.gz ONRWLOUFZFGPOI-HOCLYGCPSA-N 1 1 328.387 4.154 20 5 EIBDMO COc1cccc([C@H]2CC[N@H+]([C@@H](C)Cc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC001173231934 1050359275 /nfs/dbraw/zinc/35/92/75/1050359275.db2.gz OZKWTDOOHDYGQX-YJBOKZPZSA-N 1 1 340.423 4.024 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC001173231746 1050359597 /nfs/dbraw/zinc/35/95/97/1050359597.db2.gz CWUNUTPISLMGRX-PBHICJAKSA-N 1 1 328.387 4.154 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC001173231775 1050360646 /nfs/dbraw/zinc/36/06/46/1050360646.db2.gz CZQSFLRGAXKIFT-WMLDXEAASA-N 1 1 328.387 4.154 20 5 EIBDMO COc1cccc(CCC[N@@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173235350 1050361551 /nfs/dbraw/zinc/36/15/51/1050361551.db2.gz WHYOOWGKGZYODU-INIZCTEOSA-N 1 1 342.439 4.099 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2cc(Cl)ccc2C1 ZINC001173234233 1050361602 /nfs/dbraw/zinc/36/16/02/1050361602.db2.gz QGPTUCLOBZDTOO-ZDUSSCGKSA-N 1 1 330.815 4.238 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2ccc3c(c2)CCCC3)c1 ZINC001178176147 1050394277 /nfs/dbraw/zinc/39/42/77/1050394277.db2.gz FYICHUGDIJDCNT-UHFFFAOYSA-N 1 1 330.815 4.417 20 5 EIBDMO CC[C@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])c1ccccc1OC ZINC000775085162 1050482173 /nfs/dbraw/zinc/48/21/73/1050482173.db2.gz XOJSAOKGCXWTMV-HNNXBMFYSA-N 1 1 334.803 4.498 20 5 EIBDMO C[C@H]([N@@H+](C)Cc1cc(Br)c([N+](=O)[O-])s1)C1(C)CC1 ZINC001179973671 1050838939 /nfs/dbraw/zinc/83/89/39/1050838939.db2.gz FCQWUWZNPYSIJB-QMMMGPOBSA-N 1 1 333.251 4.039 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@H](Cc2ccc(F)cc2)C1 ZINC001179958152 1050846412 /nfs/dbraw/zinc/84/64/12/1050846412.db2.gz VYOJXMDNLHBOPL-QGZVFWFLSA-N 1 1 342.414 4.415 20 5 EIBDMO C[N@@H+](CCCOc1ccc(Cl)cc1)CCc1ccc([N+](=O)[O-])cc1 ZINC001190426366 1051181132 /nfs/dbraw/zinc/18/11/32/1051181132.db2.gz FBMRDZHADKMNPS-UHFFFAOYSA-N 1 1 348.830 4.192 20 5 EIBDMO C[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000183707224 1051309641 /nfs/dbraw/zinc/30/96/41/1051309641.db2.gz LEAVNZGCAPBSIH-AWEZNQCLSA-N 1 1 337.379 4.443 20 5 EIBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CCC[C@@H](C2CC2)C1 ZINC001182181853 1051413354 /nfs/dbraw/zinc/41/33/54/1051413354.db2.gz BFDWVKHJQKUNQS-GFCCVEGCSA-N 1 1 328.334 4.236 20 5 EIBDMO COc1ccc(C[N@H+]2CC[C@@H](Cc3ccccc3)[C@@H]2C)cc1[N+](=O)[O-] ZINC001191475994 1051462769 /nfs/dbraw/zinc/46/27/69/1051462769.db2.gz QQDOYBCCPOXBEH-YJBOKZPZSA-N 1 1 340.423 4.057 20 5 EIBDMO CCOc1cc(C[N@@H+]2CCc3ccsc3[C@H]2C)ccc1[N+](=O)[O-] ZINC001175830940 1051794667 /nfs/dbraw/zinc/79/46/67/1051794667.db2.gz LQPHWVBQHNVPDT-GFCCVEGCSA-N 1 1 332.425 4.174 20 5 EIBDMO CCOc1cc(C[N@H+]2CCc3ccsc3[C@H]2C)ccc1[N+](=O)[O-] ZINC001175830940 1051794674 /nfs/dbraw/zinc/79/46/74/1051794674.db2.gz LQPHWVBQHNVPDT-GFCCVEGCSA-N 1 1 332.425 4.174 20 5 EIBDMO C[C@H]1C[N@@H+](Cc2c3ccccc3cc3ccccc32)CC[S@@](=O)C1 ZINC000763651431 1051813169 /nfs/dbraw/zinc/81/31/69/1051813169.db2.gz ICGHBXJWXPOZNN-UPCLLVRISA-N 1 1 337.488 4.193 20 5 EIBDMO C[C@H](c1ccco1)[N@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000131059513 1051839934 /nfs/dbraw/zinc/83/99/34/1051839934.db2.gz PURLIGGECJPZCU-SNVBAGLBSA-N 1 1 339.189 4.143 20 5 EIBDMO C[C@H](c1ccco1)[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000131059513 1051839938 /nfs/dbraw/zinc/83/99/38/1051839938.db2.gz PURLIGGECJPZCU-SNVBAGLBSA-N 1 1 339.189 4.143 20 5 EIBDMO C[N@H+](CCOc1ccccc1C(C)(C)C)Cc1ccccc1[N+](=O)[O-] ZINC001193914784 1052028647 /nfs/dbraw/zinc/02/86/47/1052028647.db2.gz WUZFMBGASOXEOP-UHFFFAOYSA-N 1 1 342.439 4.403 20 5 EIBDMO C[N@@H+](CCOc1ccccc1C(C)(C)C)Cc1ccccc1[N+](=O)[O-] ZINC001193914784 1052028656 /nfs/dbraw/zinc/02/86/56/1052028656.db2.gz WUZFMBGASOXEOP-UHFFFAOYSA-N 1 1 342.439 4.403 20 5 EIBDMO C[C@@H](c1ccccc1)[C@H]1CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001176356845 1052035063 /nfs/dbraw/zinc/03/50/63/1052035063.db2.gz VZAVBHJNEUGKGI-OXJNMPFZSA-N 1 1 340.423 4.242 20 5 EIBDMO CC(C)Cc1ccccc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC001194263420 1052121103 /nfs/dbraw/zinc/12/11/03/1052121103.db2.gz ZYOLSXJLIANJIS-UHFFFAOYSA-N 1 1 326.440 4.468 20 5 EIBDMO CC[C@H](C)[C@@H](C)[N@@H+]1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC001194291478 1052129055 /nfs/dbraw/zinc/12/90/55/1052129055.db2.gz OVNPKYOWMATUPV-WDEREUQCSA-N 1 1 341.249 4.150 20 5 EIBDMO CC[C@H](C)[C@@H](C)[N@H+]1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC001194291478 1052129058 /nfs/dbraw/zinc/12/90/58/1052129058.db2.gz OVNPKYOWMATUPV-WDEREUQCSA-N 1 1 341.249 4.150 20 5 EIBDMO CC[N@@H+](C[C@@H](O)c1ccc(C)cc1)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000764285656 1053052206 /nfs/dbraw/zinc/05/22/06/1053052206.db2.gz YJKOQLKNTFYXJV-HNAYVOBHSA-N 1 1 328.412 4.020 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@](C)(C(=O)OC(C)(C)C)C1 ZINC001194905783 1053156339 /nfs/dbraw/zinc/15/63/39/1053156339.db2.gz LMFZVMJKNUAVPP-AUUYWEPGSA-N 1 1 348.443 4.018 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccc2c(c1)CCCO2 ZINC000850463181 1053240745 /nfs/dbraw/zinc/24/07/45/1053240745.db2.gz XKDDPYDXGDZQSZ-GFCCVEGCSA-N 1 1 346.814 4.424 20 5 EIBDMO COc1cc(C[N@@H+](C)[C@@H]2CCC[C@H]2C(C)(C)C)c([N+](=O)[O-])cc1F ZINC001195279896 1053358677 /nfs/dbraw/zinc/35/86/77/1053358677.db2.gz PNCQHIXZSQNDTQ-UKRRQHHQSA-N 1 1 338.423 4.389 20 5 EIBDMO CCNC(=S)Nc1cc2[nH+]c3cc(N(C)C)ccc3cc2cc1C ZINC001195348291 1053377729 /nfs/dbraw/zinc/37/77/29/1053377729.db2.gz ZYIMJUVYDAIAQY-UHFFFAOYSA-N 1 1 338.480 4.069 20 5 EIBDMO CC(C)[N@@H+](C)CC1CCN(c2ccc([N+](=O)[O-])cc2C(F)F)CC1 ZINC000865454589 1053512608 /nfs/dbraw/zinc/51/26/08/1053512608.db2.gz DADBBZDOGADFEP-UHFFFAOYSA-N 1 1 341.402 4.089 20 5 EIBDMO Cc1ccc([C@@H]2CCCC[N@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776585318 1053560427 /nfs/dbraw/zinc/56/04/27/1053560427.db2.gz VFXFPIHOYBUHLF-VQTJNVASSA-N 1 1 340.423 4.164 20 5 EIBDMO Cc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000776589565 1053575487 /nfs/dbraw/zinc/57/54/87/1053575487.db2.gz TVGRDIUJXZRUHC-DOPJRALCSA-N 1 1 344.411 4.003 20 5 EIBDMO Cc1ccc(C[NH2+]Cc2ccc(CSC(F)F)o2)cc1[N+](=O)[O-] ZINC000865786522 1053593288 /nfs/dbraw/zinc/59/32/88/1053593288.db2.gz PNEPROBDXHTHSC-UHFFFAOYSA-N 1 1 342.367 4.242 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC([C@H]2CCCCO2)CC1 ZINC000852594372 1053594192 /nfs/dbraw/zinc/59/41/92/1053594192.db2.gz MHOJPTYYTOSMHO-QGZVFWFLSA-N 1 1 338.835 4.029 20 5 EIBDMO C[N@H+](CC1=CCSC1)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000852747516 1053608976 /nfs/dbraw/zinc/60/89/76/1053608976.db2.gz MHIBOUHHHUYGFG-UHFFFAOYSA-N 1 1 333.240 4.007 20 5 EIBDMO C[N@@H+](CC1=CCSC1)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000852747516 1053608980 /nfs/dbraw/zinc/60/89/80/1053608980.db2.gz MHIBOUHHHUYGFG-UHFFFAOYSA-N 1 1 333.240 4.007 20 5 EIBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H](C3CCCCC3)C2)c1 ZINC001196410138 1053665880 /nfs/dbraw/zinc/66/58/80/1053665880.db2.gz NKSGZBYLMFPRBV-KRWDZBQOSA-N 1 1 332.444 4.266 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](C)c1cc2cnccc2o1 ZINC000866623076 1053810397 /nfs/dbraw/zinc/81/03/97/1053810397.db2.gz ROJOJTSWCVKBKP-NEPJUHHUSA-N 1 1 341.367 4.156 20 5 EIBDMO CC(C)c1cc([C@H]2CCC[N@H+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)[nH]n1 ZINC001197542352 1053932389 /nfs/dbraw/zinc/93/23/89/1053932389.db2.gz KQKADVBJKJEQIZ-CABCVRRESA-N 1 1 342.443 4.382 20 5 EIBDMO CC(C)c1cc([C@H]2CCC[N@@H+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)n[nH]1 ZINC001197542352 1053932400 /nfs/dbraw/zinc/93/24/00/1053932400.db2.gz KQKADVBJKJEQIZ-CABCVRRESA-N 1 1 342.443 4.382 20 5 EIBDMO CC(C)c1cc([C@H]2CCC[N@H+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)n[nH]1 ZINC001197542352 1053932409 /nfs/dbraw/zinc/93/24/09/1053932409.db2.gz KQKADVBJKJEQIZ-CABCVRRESA-N 1 1 342.443 4.382 20 5 EIBDMO C[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccc2ncsc2c1 ZINC000776818795 1053947177 /nfs/dbraw/zinc/94/71/77/1053947177.db2.gz MQHBKKCTHMYSKI-SNVBAGLBSA-N 1 1 331.372 4.194 20 5 EIBDMO CC(C)(C)OC[C@@H]1CCC[N@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001197639730 1053969413 /nfs/dbraw/zinc/96/94/13/1053969413.db2.gz TUEVHPIQZAKLRF-ZDUSSCGKSA-N 1 1 326.824 4.028 20 5 EIBDMO COc1ccc(C[N@H+]2C[C@@H](c3ccccc3)CC2(C)C)cc1[N+](=O)[O-] ZINC001198289433 1054116470 /nfs/dbraw/zinc/11/64/70/1054116470.db2.gz OKDKGINNPJQYAI-KRWDZBQOSA-N 1 1 340.423 4.372 20 5 EIBDMO Cc1cccnc1[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC001198641609 1054215989 /nfs/dbraw/zinc/21/59/89/1054215989.db2.gz SRMZSMRNBYGGNF-NSHDSACASA-N 1 1 339.317 4.168 20 5 EIBDMO CC[C@H](C[N@@H+](CC)C[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000775895887 1054278357 /nfs/dbraw/zinc/27/83/57/1054278357.db2.gz OYWFMUPHHUHFPD-UZLBHIALSA-N 1 1 342.439 4.144 20 5 EIBDMO CCc1noc(C)c1C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872072878 1054378680 /nfs/dbraw/zinc/37/86/80/1054378680.db2.gz KZVWRPBLMWGIAE-JTQLQIEISA-N 1 1 335.429 4.026 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](OC3CCC3)CC2)ccc1Cl ZINC000872260620 1054428241 /nfs/dbraw/zinc/42/82/41/1054428241.db2.gz QDLZWAFNMLUZGD-OAHLLOKOSA-N 1 1 338.835 4.172 20 5 EIBDMO Cc1cccc2c1OCC[C@H]2[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000776151567 1054738745 /nfs/dbraw/zinc/73/87/45/1054738745.db2.gz PPAUVKNOUJINMB-OAHLLOKOSA-N 1 1 332.787 4.170 20 5 EIBDMO Cc1csc([C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])c(Cl)c3)C2)n1 ZINC000877813658 1055125188 /nfs/dbraw/zinc/12/51/88/1055125188.db2.gz IVOYHTBMEVCSQB-LBPRGKRZSA-N 1 1 337.832 4.003 20 5 EIBDMO CCC[C@H](C)[C@@H]1CCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878199478 1055204401 /nfs/dbraw/zinc/20/44/01/1055204401.db2.gz AZFIDPDXQGZACE-ZFWWWQNUSA-N 1 1 344.415 4.045 20 5 EIBDMO CC(C)n1cc2c(n1)[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)CCC2 ZINC000765818776 1055569483 /nfs/dbraw/zinc/56/94/83/1055569483.db2.gz OOMJEIFVDLYEHG-CXAGYDPISA-N 1 1 328.416 4.100 20 5 EIBDMO CC[C@@H]([NH2+][C@H]1CCCc2cn(C(C)C)nc21)c1cccc([N+](=O)[O-])c1 ZINC000765821227 1055648497 /nfs/dbraw/zinc/64/84/97/1055648497.db2.gz NLIQQPPWALNLRR-MSOLQXFVSA-N 1 1 342.443 4.491 20 5 EIBDMO CCc1ccc(N2CC[NH+]([C@H](C)c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000743868346 1059179356 /nfs/dbraw/zinc/17/93/56/1059179356.db2.gz VIPHKZOYXAGWBN-MRXNPFEDSA-N 1 1 339.439 4.040 20 5 EIBDMO C[N@@H+](Cc1ccccc1Oc1ccccc1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169035196 1060588905 /nfs/dbraw/zinc/58/89/05/1060588905.db2.gz BJRPIAYNGIEQEL-WMZOPIPTSA-N 1 1 340.423 4.356 20 5 EIBDMO C[C@@]12c3ccccc3[C@@H](Cc3ccccc31)[N@@H+]2[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169047471 1060601973 /nfs/dbraw/zinc/60/19/73/1060601973.db2.gz RFGBGFIEVOMLJA-HKHXBQBMSA-N 1 1 348.446 4.308 20 5 EIBDMO Cc1ccc([C@H]2CC[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC001169198449 1060683131 /nfs/dbraw/zinc/68/31/31/1060683131.db2.gz XSWIHUORGAHDMZ-SFHVURJKSA-N 1 1 340.423 4.162 20 5 EIBDMO CC(C)[C@H]1CCC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC001169381762 1060795420 /nfs/dbraw/zinc/79/54/20/1060795420.db2.gz CDUSRIGXALVHIA-LBPRGKRZSA-N 1 1 341.249 4.225 20 5 EIBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+](CC1CC1)C1CCC1 ZINC001169734129 1060936317 /nfs/dbraw/zinc/93/63/17/1060936317.db2.gz RKYAWKQENNWNFC-UHFFFAOYSA-N 1 1 339.233 4.122 20 5 EIBDMO C[C@H]1CCC[N@@H+](Cc2ccccc2CNc2ccc([N+](=O)[O-])cc2)C1 ZINC000071954810 203153971 /nfs/dbraw/zinc/15/39/71/203153971.db2.gz UCPSXNODCWPJAF-INIZCTEOSA-N 1 1 339.439 4.439 20 5 EIBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC001307494063 1032223136 /nfs/dbraw/zinc/22/31/36/1032223136.db2.gz CUGFEVHLMVLCHA-TZMCWYRMSA-N 1 1 328.865 4.354 20 5 EIBDMO CC(=O)c1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000450282831 1032399261 /nfs/dbraw/zinc/39/92/61/1032399261.db2.gz IHJRDEDTTMATFB-UHFFFAOYSA-N 1 1 326.396 4.208 20 5 EIBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)Cc1cccc(O)c1 ZINC000533255550 1032568560 /nfs/dbraw/zinc/56/85/60/1032568560.db2.gz RPLFQMKOJCZSOI-UHFFFAOYSA-N 1 1 338.363 4.192 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@H](C)c1cccc(OC)c1 ZINC000430202418 1019262085 /nfs/dbraw/zinc/26/20/85/1019262085.db2.gz COZUQOWUCCLBOZ-CQSZACIVSA-N 1 1 344.411 4.195 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1c1ccc(C)s1 ZINC000430206282 1019309179 /nfs/dbraw/zinc/30/91/79/1019309179.db2.gz KMAKXGGQDBRQDZ-OAHLLOKOSA-N 1 1 332.425 4.310 20 5 EIBDMO C[C@H]1C[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])CC[C@H]1c1ccccc1 ZINC000610216207 1019397623 /nfs/dbraw/zinc/39/76/23/1019397623.db2.gz ZRXWBPYKOMLOTE-GOEBONIOSA-N 1 1 328.387 4.360 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@H](C)c1ccc(F)cc1 ZINC001167132124 1020308397 /nfs/dbraw/zinc/30/83/97/1020308397.db2.gz XNAGHOYQGBCAOE-CYBMUJFWSA-N 1 1 332.375 4.326 20 5 EIBDMO COc1ccc(C[N@@H+]2CC[C@@H](C)C[C@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000610372203 1021554941 /nfs/dbraw/zinc/55/49/41/1021554941.db2.gz ZVQMNSSRFNXLPV-HIFRSBDPSA-N 1 1 330.384 4.170 20 5 EIBDMO COc1ccc(C[N@H+]2CC[C@@H](C)C[C@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000610372203 1021554953 /nfs/dbraw/zinc/55/49/53/1021554953.db2.gz ZVQMNSSRFNXLPV-HIFRSBDPSA-N 1 1 330.384 4.170 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000581230419 1021838345 /nfs/dbraw/zinc/83/83/45/1021838345.db2.gz DUKCIEYNNVEWNI-WEKMIXOTSA-N 1 1 328.334 4.272 20 5 EIBDMO CCC[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@H]1CCCCO1 ZINC000581392289 1021849152 /nfs/dbraw/zinc/84/91/52/1021849152.db2.gz QEZHNNBFVTUVGP-OAHLLOKOSA-N 1 1 326.824 4.029 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@@H]1CCOc2ccc(F)cc21 ZINC000275879178 1021993088 /nfs/dbraw/zinc/99/30/88/1021993088.db2.gz WJSUBKOVMMCVII-CQSZACIVSA-N 1 1 336.750 4.001 20 5 EIBDMO COc1ccc(C[N@H+]2CCCCC[C@@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000120439109 1033039533 /nfs/dbraw/zinc/03/95/33/1033039533.db2.gz XLWGWCWREQPKGA-QGZVFWFLSA-N 1 1 341.411 4.116 20 5 EIBDMO C[C@@H]1CCC[C@@H]([N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000170909074 1022418306 /nfs/dbraw/zinc/41/83/06/1022418306.db2.gz XVUNWWJJTOHDPM-GDBMZVCRSA-N 1 1 343.427 4.303 20 5 EIBDMO C[C@@H]([NH2+]Cc1nc2ccccc2n1C(F)F)c1cccc([N+](=O)[O-])c1 ZINC000180394552 1022625477 /nfs/dbraw/zinc/62/54/77/1022625477.db2.gz RJSDZBOZNSTTFN-LLVKDONJSA-N 1 1 346.337 4.190 20 5 EIBDMO COCc1ccc([C@H]2CCC[N@H+]2C/C=C\c2ccccc2[N+](=O)[O-])o1 ZINC000468693229 1023107619 /nfs/dbraw/zinc/10/76/19/1023107619.db2.gz IGMCNRLXJWSASR-NCRRVARUSA-N 1 1 342.395 4.185 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1nc(C3CC3)cs1)CCCC2 ZINC000417307328 1023256152 /nfs/dbraw/zinc/25/61/52/1023256152.db2.gz FYMDMMVQBIGSNK-INIZCTEOSA-N 1 1 343.452 4.486 20 5 EIBDMO CCc1nc(C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)cs1 ZINC000417314330 1023259916 /nfs/dbraw/zinc/25/99/16/1023259916.db2.gz QWTHYMMUIBXKNX-MRXNPFEDSA-N 1 1 331.441 4.171 20 5 EIBDMO C[N@H+](Cc1cccc([N+](=O)[O-])c1)C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000051132339 1023469249 /nfs/dbraw/zinc/46/92/49/1023469249.db2.gz AIUASQZZGBFPHP-AZUAARDMSA-N 1 1 340.423 4.195 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(Cc3ccc(F)cc3)CC2)cs1 ZINC000110303149 1023667339 /nfs/dbraw/zinc/66/73/39/1023667339.db2.gz YESODTJUUWNPEO-UHFFFAOYSA-N 1 1 334.416 4.250 20 5 EIBDMO CC[C@H]([NH2+]Cc1c(Cl)cccc1[N+](=O)[O-])c1ccc(OC)cc1 ZINC000119634037 1023678615 /nfs/dbraw/zinc/67/86/15/1023678615.db2.gz SUTTXYMREPRUGR-INIZCTEOSA-N 1 1 334.803 4.498 20 5 EIBDMO CC(C)c1ncc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000341536872 1023837659 /nfs/dbraw/zinc/83/76/59/1023837659.db2.gz VJVYREAXMABMSZ-UHFFFAOYSA-N 1 1 325.821 4.118 20 5 EIBDMO CC(C)[N@H+](Cc1nc2cccnc2s1)Cc1ccc([N+](=O)[O-])cc1 ZINC000341582072 1023888570 /nfs/dbraw/zinc/88/85/70/1023888570.db2.gz HUQFBDFVZOUCST-UHFFFAOYSA-N 1 1 342.424 4.010 20 5 EIBDMO CC(C)[N@@H+](Cc1nc2cccnc2s1)Cc1ccc([N+](=O)[O-])cc1 ZINC000341582072 1023888573 /nfs/dbraw/zinc/88/85/73/1023888573.db2.gz HUQFBDFVZOUCST-UHFFFAOYSA-N 1 1 342.424 4.010 20 5 EIBDMO CC(C)([NH2+]Cc1c[nH]c(-c2ccccc2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000176002144 1023907271 /nfs/dbraw/zinc/90/72/71/1023907271.db2.gz ZKTFFDMZEIESEU-UHFFFAOYSA-N 1 1 336.395 4.010 20 5 EIBDMO Cc1cc(CNc2c(Cl)cccc2[N+](=O)[O-])cc(N2CCCC2)[nH+]1 ZINC000432180152 1023936161 /nfs/dbraw/zinc/93/61/61/1023936161.db2.gz UPUQDUPSTVMLCE-UHFFFAOYSA-N 1 1 346.818 4.164 20 5 EIBDMO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610580820 1024107732 /nfs/dbraw/zinc/10/77/32/1024107732.db2.gz QYTMBWHVOMAMMV-LLVKDONJSA-N 1 1 329.331 4.068 20 5 EIBDMO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610580820 1024107748 /nfs/dbraw/zinc/10/77/48/1024107748.db2.gz QYTMBWHVOMAMMV-LLVKDONJSA-N 1 1 329.331 4.068 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+](CC3CCCCC3)C3CC3)nc2c1 ZINC000610581267 1024115389 /nfs/dbraw/zinc/11/53/89/1024115389.db2.gz SCTRRWQCRBQTGZ-UHFFFAOYSA-N 1 1 329.400 4.281 20 5 EIBDMO CC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610582762 1024164622 /nfs/dbraw/zinc/16/46/22/1024164622.db2.gz WWYWLJZGHJFNRE-HNNXBMFYSA-N 1 1 339.395 4.189 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(F)c(Cl)c2Cl)cc1 ZINC000432235483 1024626560 /nfs/dbraw/zinc/62/65/60/1024626560.db2.gz JADXNQAAIDPAQN-UHFFFAOYSA-N 1 1 329.158 4.331 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@H](c1ccccn1)C1CCC1 ZINC000599573668 1024889618 /nfs/dbraw/zinc/88/96/18/1024889618.db2.gz KIQFEQUCLLBKIV-KRWDZBQOSA-N 1 1 331.803 4.274 20 5 EIBDMO C[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1cccc(N2CCCC2)c1 ZINC000181880549 1025266123 /nfs/dbraw/zinc/26/61/23/1025266123.db2.gz XUXZUHRFVIBRLL-CQSZACIVSA-N 1 1 343.402 4.185 20 5 EIBDMO Cc1csc(C2([NH2+][C@@H]3CCCc4ccc([N+](=O)[O-])cc43)CCC2)n1 ZINC000278891848 1025334246 /nfs/dbraw/zinc/33/42/46/1025334246.db2.gz YPUXXUZMCZRKMV-MRXNPFEDSA-N 1 1 343.452 4.406 20 5 EIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+](CC2CC2)C2CCC2)c1 ZINC000549613562 1025349698 /nfs/dbraw/zinc/34/96/98/1025349698.db2.gz NPWWHVMKDOTVHD-UHFFFAOYSA-N 1 1 328.334 4.378 20 5 EIBDMO Cc1[nH+]ccn1CCCCNc1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000342353555 1025356837 /nfs/dbraw/zinc/35/68/37/1025356837.db2.gz WKGBJNKZRFRWRN-UHFFFAOYSA-N 1 1 343.214 4.299 20 5 EIBDMO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000611561491 1025385473 /nfs/dbraw/zinc/38/54/73/1025385473.db2.gz RMIUHHFUJDGHHO-FAQJLRJSSA-N 1 1 328.334 4.271 20 5 EIBDMO C[C@H]([NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccncc1F ZINC000511034280 1025765294 /nfs/dbraw/zinc/76/52/94/1025765294.db2.gz QXCJRWYOILFQNH-GTNSWQLSSA-N 1 1 329.375 4.202 20 5 EIBDMO CC[N@@H+](C[C@H](O)c1ccc(C)cc1)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC001167517890 1025899773 /nfs/dbraw/zinc/89/97/73/1025899773.db2.gz SKVSTZQXNXJRSJ-UZLBHIALSA-N 1 1 342.439 4.328 20 5 EIBDMO COc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000051375685 1025954050 /nfs/dbraw/zinc/95/40/50/1025954050.db2.gz RCLGWLJMBCPMBN-INIZCTEOSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000051375685 1025954077 /nfs/dbraw/zinc/95/40/77/1025954077.db2.gz RCLGWLJMBCPMBN-INIZCTEOSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1ccc([C@@H]([NH2+]Cc2c(F)cccc2[N+](=O)[O-])C(C)C)cc1 ZINC000182055140 1026018359 /nfs/dbraw/zinc/01/83/59/1026018359.db2.gz QCWYUMGGABWNGS-SFHVURJKSA-N 1 1 332.375 4.229 20 5 EIBDMO CCCCC[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)C ZINC000072970248 1026097828 /nfs/dbraw/zinc/09/78/28/1026097828.db2.gz UHAMSNUQZIXJGG-UHFFFAOYSA-N 1 1 332.404 4.045 20 5 EIBDMO CC[N@@H+](Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)C1CCCCC1 ZINC000728896691 1026170981 /nfs/dbraw/zinc/17/09/81/1026170981.db2.gz SRPYJHKXWKYPQS-UHFFFAOYSA-N 1 1 328.416 4.070 20 5 EIBDMO COc1cc(C[NH2+][C@@H](C)c2ccc(Cl)cc2)c([N+](=O)[O-])cc1F ZINC000184239377 1026250686 /nfs/dbraw/zinc/25/06/86/1026250686.db2.gz SVFDATWRIGFTSE-JTQLQIEISA-N 1 1 338.766 4.247 20 5 EIBDMO Cc1cc(C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c2ccccc2n1 ZINC000550197447 1026315337 /nfs/dbraw/zinc/31/53/37/1026315337.db2.gz RIOGLMKYUCNXGK-UHFFFAOYSA-N 1 1 333.391 4.010 20 5 EIBDMO CCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H](C)c1cc2ccccc2o1 ZINC000478409260 1026560356 /nfs/dbraw/zinc/56/03/56/1026560356.db2.gz XXKMNBVEFMXHRA-CQSZACIVSA-N 1 1 342.399 4.011 20 5 EIBDMO CCCO[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000182159142 1026619687 /nfs/dbraw/zinc/61/96/87/1026619687.db2.gz VORNVQCKUWUNEP-OAHLLOKOSA-N 1 1 326.824 4.029 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1cccc(OC(F)F)c1)C1CC1 ZINC000507167453 1026675351 /nfs/dbraw/zinc/67/53/51/1026675351.db2.gz LWIJTYOXFYXGFV-UHFFFAOYSA-N 1 1 348.349 4.361 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cccc(OC(F)F)c1)C1CC1 ZINC000507167453 1026675362 /nfs/dbraw/zinc/67/53/62/1026675362.db2.gz LWIJTYOXFYXGFV-UHFFFAOYSA-N 1 1 348.349 4.361 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cc(F)c(F)c(F)c2)C2CC2)cc1 ZINC000507167208 1026682721 /nfs/dbraw/zinc/68/27/21/1026682721.db2.gz JWTNADZTARRBBW-UHFFFAOYSA-N 1 1 336.313 4.177 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cc(F)c(F)c(F)c2)C2CC2)cc1 ZINC000507167208 1026682728 /nfs/dbraw/zinc/68/27/28/1026682728.db2.gz JWTNADZTARRBBW-UHFFFAOYSA-N 1 1 336.313 4.177 20 5 EIBDMO CCCOc1cc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])ccc1OC ZINC000507174904 1026686364 /nfs/dbraw/zinc/68/63/64/1026686364.db2.gz TUQCPNQWDVOHPO-UHFFFAOYSA-N 1 1 344.411 4.024 20 5 EIBDMO CCCOc1cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])ccc1OC ZINC000507174904 1026686369 /nfs/dbraw/zinc/68/63/69/1026686369.db2.gz TUQCPNQWDVOHPO-UHFFFAOYSA-N 1 1 344.411 4.024 20 5 EIBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCCCC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000472253990 1027219144 /nfs/dbraw/zinc/21/91/44/1027219144.db2.gz BFJLDWXMTPCMOR-QGZVFWFLSA-N 1 1 348.834 4.062 20 5 EIBDMO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000441335336 1027452610 /nfs/dbraw/zinc/45/26/10/1027452610.db2.gz FOADINQQQMURIR-XIKOKIGWSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000441335336 1027452622 /nfs/dbraw/zinc/45/26/22/1027452622.db2.gz FOADINQQQMURIR-XIKOKIGWSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000441379201 1027502569 /nfs/dbraw/zinc/50/25/69/1027502569.db2.gz FIAGQGNEDIMUSI-ZBFHGGJFSA-N 1 1 328.387 4.360 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000441401216 1027524364 /nfs/dbraw/zinc/52/43/64/1027524364.db2.gz XUZQZULIUKAJAR-FGTMMUONSA-N 1 1 345.487 4.242 20 5 EIBDMO COc1ccccc1[C@@H]1CC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000441406646 1027541029 /nfs/dbraw/zinc/54/10/29/1027541029.db2.gz YHUMRHVHDNEODF-HUUCEWRRSA-N 1 1 326.396 4.154 20 5 EIBDMO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H](C)c1ccc(F)cc1 ZINC000444580257 1027883210 /nfs/dbraw/zinc/88/32/10/1027883210.db2.gz CCLKCQVNPYTWQU-GFCCVEGCSA-N 1 1 342.374 4.193 20 5 EIBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H](C)c1ccc(F)cc1 ZINC000444580257 1027883221 /nfs/dbraw/zinc/88/32/21/1027883221.db2.gz CCLKCQVNPYTWQU-GFCCVEGCSA-N 1 1 342.374 4.193 20 5 EIBDMO CC(C)[C@H](c1ccccc1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444640885 1027935394 /nfs/dbraw/zinc/93/53/94/1027935394.db2.gz CUALVXOJBPAWBE-LJQANCHMSA-N 1 1 338.411 4.300 20 5 EIBDMO Cc1ccc(C)c([C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)[C@@H](C)CO2)c1 ZINC000441461893 1028070164 /nfs/dbraw/zinc/07/01/64/1028070164.db2.gz HRTZTGWQBKRZRK-JXFKEZNVSA-N 1 1 340.423 4.174 20 5 EIBDMO Cc1ccc(C)c([C@@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)[C@@H](C)CO2)c1 ZINC000441461893 1028070186 /nfs/dbraw/zinc/07/01/86/1028070186.db2.gz HRTZTGWQBKRZRK-JXFKEZNVSA-N 1 1 340.423 4.174 20 5 EIBDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000536365480 1028155411 /nfs/dbraw/zinc/15/54/11/1028155411.db2.gz LHOJEYGQXNUHDY-SIIHOXLZSA-N 1 1 341.411 4.403 20 5 EIBDMO COc1c(C)c[nH+]c(CN(C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1C ZINC000445583079 1028745644 /nfs/dbraw/zinc/74/56/44/1028745644.db2.gz JZAVBBVMWVNPSU-OAHLLOKOSA-N 1 1 343.427 4.117 20 5 EIBDMO COc1c(C)cnc(C[N@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1C ZINC000445583079 1028745658 /nfs/dbraw/zinc/74/56/58/1028745658.db2.gz JZAVBBVMWVNPSU-OAHLLOKOSA-N 1 1 343.427 4.117 20 5 EIBDMO COc1c(C)cnc(C[N@@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1C ZINC000445583079 1028745681 /nfs/dbraw/zinc/74/56/81/1028745681.db2.gz JZAVBBVMWVNPSU-OAHLLOKOSA-N 1 1 343.427 4.117 20 5 EIBDMO CC[C@@H]1c2ccsc2CC[N@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000524289343 1028843213 /nfs/dbraw/zinc/84/32/13/1028843213.db2.gz OIOIFBFLECDQOL-CQSZACIVSA-N 1 1 332.425 4.174 20 5 EIBDMO CC[C@@H]1c2ccsc2CC[N@@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000524289343 1028843219 /nfs/dbraw/zinc/84/32/19/1028843219.db2.gz OIOIFBFLECDQOL-CQSZACIVSA-N 1 1 332.425 4.174 20 5 EIBDMO C[C@H]1SCC[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000522835838 1028985740 /nfs/dbraw/zinc/98/57/40/1028985740.db2.gz JGQPICGUEZRUTP-RDTXWAMCSA-N 1 1 328.437 4.273 20 5 EIBDMO C[C@H]1SCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000522835838 1028985758 /nfs/dbraw/zinc/98/57/58/1028985758.db2.gz JGQPICGUEZRUTP-RDTXWAMCSA-N 1 1 328.437 4.273 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000248669096 1029131332 /nfs/dbraw/zinc/13/13/32/1029131332.db2.gz AMRLLNXEWUFIGY-YWZLYKJASA-N 1 1 338.407 4.096 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(Cl)nc2Cl)cc1[N+](=O)[O-] ZINC000278646877 1029645615 /nfs/dbraw/zinc/64/56/15/1029645615.db2.gz PMTILRSYVLXGPO-SNVBAGLBSA-N 1 1 340.210 4.456 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(F)(c3ccccn3)CC2)c(Cl)c1 ZINC000450931576 1030103912 /nfs/dbraw/zinc/10/39/12/1030103912.db2.gz PRYVAZLAXKMAGM-UHFFFAOYSA-N 1 1 349.793 4.104 20 5 EIBDMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1Br ZINC001307505847 1030332157 /nfs/dbraw/zinc/33/21/57/1030332157.db2.gz JOOOETOCFSDJPR-ZDUSSCGKSA-N 1 1 341.249 4.368 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1nc(C)c2ccccc2n1 ZINC000527288613 1030610549 /nfs/dbraw/zinc/61/05/49/1030610549.db2.gz RHECNYSEFFQZSL-GXDHUFHOSA-N 1 1 348.406 4.040 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1nc(C)c2ccccc2n1 ZINC000527288614 1030611371 /nfs/dbraw/zinc/61/13/71/1030611371.db2.gz RHECNYSEFFQZSL-UVTDQMKNSA-N 1 1 348.406 4.040 20 5 EIBDMO COc1ccc(C[N@@H+]2CC[C@H](C)C[C@@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000610372202 1030697208 /nfs/dbraw/zinc/69/72/08/1030697208.db2.gz ZVQMNSSRFNXLPV-DZGCQCFKSA-N 1 1 330.384 4.170 20 5 EIBDMO COc1ccc(C[N@H+]2CC[C@H](C)C[C@@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000610372202 1030697226 /nfs/dbraw/zinc/69/72/26/1030697226.db2.gz ZVQMNSSRFNXLPV-DZGCQCFKSA-N 1 1 330.384 4.170 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@@H]3CCC3CCCC3)nc2c1 ZINC001168176725 1030745903 /nfs/dbraw/zinc/74/59/03/1030745903.db2.gz YEMNTAHVNPBJKS-OAHLLOKOSA-N 1 1 342.443 4.406 20 5 EIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC=C(c2ccc(O)cc2)CC1 ZINC000179803396 1031312900 /nfs/dbraw/zinc/31/29/00/1031312900.db2.gz SVTWHGGPZQBVGJ-HWKANZROSA-N 1 1 336.391 4.103 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000548934991 1031586993 /nfs/dbraw/zinc/58/69/93/1031586993.db2.gz ZPSUDXIOKQUZDQ-AWEZNQCLSA-N 1 1 328.334 4.149 20 5 EIBDMO C[C@H]([NH2+][C@@H]1CCc2cc(F)c(F)c(F)c21)c1ccc([N+](=O)[O-])cc1 ZINC000449347907 1031645443 /nfs/dbraw/zinc/64/54/43/1031645443.db2.gz JRTUKGFSVLOVCL-LKFCYVNXSA-N 1 1 336.313 4.350 20 5 EIBDMO CC(C)(C)C[C@H]1CCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000127700431 1031707443 /nfs/dbraw/zinc/70/74/43/1031707443.db2.gz AESNHCROZBAUKD-OAHLLOKOSA-N 1 1 344.415 4.045 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](c1cccnc1)C1CC1 ZINC000347374675 1031964381 /nfs/dbraw/zinc/96/43/81/1031964381.db2.gz XGADJDAUZQDUKX-LJQANCHMSA-N 1 1 341.411 4.018 20 5 EIBDMO COC[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000449775644 1031999438 /nfs/dbraw/zinc/99/94/38/1031999438.db2.gz MZMQIDRGELOSHH-HNNXBMFYSA-N 1 1 344.411 4.103 20 5 EIBDMO CC1(C)C[C@@H](NC2CC(C)(C)[NH2+]C(C)(C)C2)c2cc([N+](=O)[O-])ccc21 ZINC000433145190 1033937790 /nfs/dbraw/zinc/93/77/90/1033937790.db2.gz PKXDXKVRHKAPPI-QGZVFWFLSA-N 1 1 345.487 4.216 20 5 EIBDMO C[NH+](C)[C@@H](CNc1ccc([N+](=O)[O-])cc1F)c1ccccc1Cl ZINC000513084946 1034508094 /nfs/dbraw/zinc/50/80/94/1034508094.db2.gz XGRQKECGOIYPSL-INIZCTEOSA-N 1 1 337.782 4.102 20 5 EIBDMO COc1ccccc1C[C@H](C)[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000513479527 1034980981 /nfs/dbraw/zinc/98/09/81/1034980981.db2.gz NGHQYBGJZHLMKB-KXKDPZRNSA-N 1 1 340.423 4.180 20 5 EIBDMO COc1ccc(F)cc1[C@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595014836 1035508230 /nfs/dbraw/zinc/50/82/30/1035508230.db2.gz UQAHTGZBUCYYBM-NEPJUHHUSA-N 1 1 348.374 4.163 20 5 EIBDMO COc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595003301 1035522759 /nfs/dbraw/zinc/52/27/59/1035522759.db2.gz GMBCBCHPVMJHNM-OLZOCXBDSA-N 1 1 330.384 4.024 20 5 EIBDMO C[C@@H]([NH2+]Cc1cc(F)ccc1OC(F)F)c1ccccc1[N+](=O)[O-] ZINC000595093295 1035601592 /nfs/dbraw/zinc/60/15/92/1035601592.db2.gz HOZVJVQCYNWHQX-SNVBAGLBSA-N 1 1 340.301 4.186 20 5 EIBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000595474710 1035686968 /nfs/dbraw/zinc/68/69/68/1035686968.db2.gz DLCNRKZXZZNQPT-AWEZNQCLSA-N 1 1 346.324 4.288 20 5 EIBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000595474710 1035686972 /nfs/dbraw/zinc/68/69/72/1035686972.db2.gz DLCNRKZXZZNQPT-AWEZNQCLSA-N 1 1 346.324 4.288 20 5 EIBDMO C[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000595492044 1035688186 /nfs/dbraw/zinc/68/81/86/1035688186.db2.gz ZKRODHADTGDFKF-BJHJDKERSA-N 1 1 334.313 4.287 20 5 EIBDMO Cc1ccc(OC2CC[NH+](Cc3ccc([N+](=O)[O-])cc3F)CC2)cc1 ZINC000491081044 1035787401 /nfs/dbraw/zinc/78/74/01/1035787401.db2.gz XEWNDVJUXUIDAP-UHFFFAOYSA-N 1 1 344.386 4.086 20 5 EIBDMO Cc1c(NC(=O)CC[N@H+](C(C)C)C2CCCCC2)cccc1[N+](=O)[O-] ZINC000491111013 1035802336 /nfs/dbraw/zinc/80/23/36/1035802336.db2.gz SEDBUHGQRKSKPD-UHFFFAOYSA-N 1 1 347.459 4.275 20 5 EIBDMO C[C@@H]([NH2+][C@H]1CCc2ccccc2-n2ccnc21)c1cccc([N+](=O)[O-])c1 ZINC000596093739 1035821280 /nfs/dbraw/zinc/82/12/80/1035821280.db2.gz FTGNZBSKUYCGIS-KDOFPFPSSA-N 1 1 348.406 4.119 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC=C(c2ccc(O)cc2)CC1 ZINC000485748392 1036242845 /nfs/dbraw/zinc/24/28/45/1036242845.db2.gz WSJKYQJXNBOWKU-HNNXBMFYSA-N 1 1 338.407 4.459 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccc(C(F)F)nc2)C2CC2)c1 ZINC000602441686 1036449091 /nfs/dbraw/zinc/44/90/91/1036449091.db2.gz XMTROAAYBVBWJW-UHFFFAOYSA-N 1 1 333.338 4.092 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccc(C(F)F)nc2)C2CC2)c1 ZINC000602441686 1036449103 /nfs/dbraw/zinc/44/91/03/1036449103.db2.gz XMTROAAYBVBWJW-UHFFFAOYSA-N 1 1 333.338 4.092 20 5 EIBDMO Cc1cccc2c1CCC[C@H]2[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602722639 1036592443 /nfs/dbraw/zinc/59/24/43/1036592443.db2.gz PPSBFYANBROGLX-MRXNPFEDSA-N 1 1 337.379 4.212 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H](c2ccccn2)C2CCC2)c(Cl)c1 ZINC000598994212 1036846820 /nfs/dbraw/zinc/84/68/20/1036846820.db2.gz ZADFIAGBBSEOFY-KRWDZBQOSA-N 1 1 331.803 4.274 20 5 EIBDMO CCCCC[C@H]1CCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000486779159 1036849773 /nfs/dbraw/zinc/84/97/73/1036849773.db2.gz NIZUMCKIQMKPRX-HNNXBMFYSA-N 1 1 344.415 4.190 20 5 EIBDMO COc1cccc([C@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000603836878 1037021408 /nfs/dbraw/zinc/02/14/08/1037021408.db2.gz XUKYVEWTMFNHKL-LJQANCHMSA-N 1 1 326.396 4.249 20 5 EIBDMO C[C@H](c1cc2ccccc2o1)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000603836969 1037032284 /nfs/dbraw/zinc/03/22/84/1037032284.db2.gz FZCHAIFLTDECAL-CQSZACIVSA-N 1 1 340.379 4.413 20 5 EIBDMO COc1ccc(C[N@H+](C)[C@H](C)c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000603841140 1037035511 /nfs/dbraw/zinc/03/55/11/1037035511.db2.gz KHOWJPBWCKEJNA-LLVKDONJSA-N 1 1 336.338 4.075 20 5 EIBDMO COc1ccc(C[N@@H+](C)[C@H](C)c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000603841140 1037035527 /nfs/dbraw/zinc/03/55/27/1037035527.db2.gz KHOWJPBWCKEJNA-LLVKDONJSA-N 1 1 336.338 4.075 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC(C[NH+]2CCCCCC2)CC1 ZINC000603875744 1037068075 /nfs/dbraw/zinc/06/80/75/1037068075.db2.gz NHTNHFVPZFTKNK-KRWDZBQOSA-N 1 1 345.487 4.244 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H](c3cc4ccccc4[nH]3)C2)c1 ZINC000603889903 1037076188 /nfs/dbraw/zinc/07/61/88/1037076188.db2.gz DJCRGRRDLNBVDQ-KRWDZBQOSA-N 1 1 335.407 4.456 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H](C)C2CC2)cc1 ZINC000057601370 1037136222 /nfs/dbraw/zinc/13/62/22/1037136222.db2.gz QBLKTGOPBQYOKA-OAHLLOKOSA-N 1 1 340.423 4.404 20 5 EIBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@H]2c2ccsc2)cc1 ZINC000604012183 1037147435 /nfs/dbraw/zinc/14/74/35/1037147435.db2.gz IOEHJSOPKSMHDZ-KRWDZBQOSA-N 1 1 332.425 4.262 20 5 EIBDMO CC(C)c1cc(C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)on1 ZINC000591348025 1037391884 /nfs/dbraw/zinc/39/18/84/1037391884.db2.gz WGWWYLXFIXLFKD-KRWDZBQOSA-N 1 1 329.400 4.264 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@]1(c2ccc(Cl)cc2)C[C@H]1C ZINC000503373659 1037715804 /nfs/dbraw/zinc/71/58/04/1037715804.db2.gz XWNPZEUHXDQNSL-KZULUSFZSA-N 1 1 346.814 4.282 20 5 EIBDMO C[C@H]1C[C@]1([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000503402613 1037736888 /nfs/dbraw/zinc/73/68/88/1037736888.db2.gz BKYFIFKCLIIPEL-APPDUMDISA-N 1 1 334.778 4.412 20 5 EIBDMO COc1ccccc1C1([NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000592395309 1037785658 /nfs/dbraw/zinc/78/56/58/1037785658.db2.gz WBWIZBXYQJMEHC-CQSZACIVSA-N 1 1 326.396 4.252 20 5 EIBDMO COc1cc(C[NH2+]C2(c3ccccc3Cl)CCC2)ccc1[N+](=O)[O-] ZINC000593038229 1037906761 /nfs/dbraw/zinc/90/67/61/1037906761.db2.gz AOGXAUXZEHOCSZ-UHFFFAOYSA-N 1 1 346.814 4.426 20 5 EIBDMO CC(C)c1ccc([C@H](N)C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000423235117 1038055305 /nfs/dbraw/zinc/05/53/05/1038055305.db2.gz GHUVHXIREOMJKX-IFXJQAMLSA-N 1 1 327.428 4.069 20 5 EIBDMO COc1ccc([C@H]2CC[N@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000504519952 1038393925 /nfs/dbraw/zinc/39/39/25/1038393925.db2.gz BHJUEKPURFIZGB-PBHICJAKSA-N 1 1 326.396 4.154 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C1CC1)C1CCCCC1 ZINC000063497942 1038395497 /nfs/dbraw/zinc/39/54/97/1038395497.db2.gz AJVGGIJPQHJDHF-UHFFFAOYSA-N 1 1 345.443 4.029 20 5 EIBDMO C[C@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1cccc([N+](=O)[O-])c1 ZINC000594926147 1038430376 /nfs/dbraw/zinc/43/03/76/1038430376.db2.gz SPWZTCZGVJBMPS-LBPRGKRZSA-N 1 1 330.359 4.126 20 5 EIBDMO COc1cccc([C@@H]2C[C@H](C)C[N@@H+]2Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC001168424151 1038623152 /nfs/dbraw/zinc/62/31/52/1038623152.db2.gz UOUTWLLLPJGBOV-DJJJIMSYSA-N 1 1 344.386 4.326 20 5 EIBDMO COc1cccc([C@@H]2C[C@H](C)C[N@H+]2Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC001168424151 1038623158 /nfs/dbraw/zinc/62/31/58/1038623158.db2.gz UOUTWLLLPJGBOV-DJJJIMSYSA-N 1 1 344.386 4.326 20 5 EIBDMO Cc1ccc(C(=O)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000480860655 1038850746 /nfs/dbraw/zinc/85/07/46/1038850746.db2.gz AAMYKLVPYOHMKE-UHFFFAOYSA-N 1 1 338.407 4.141 20 5 EIBDMO Cc1nc(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)cs1 ZINC000608836192 1038923549 /nfs/dbraw/zinc/92/35/49/1038923549.db2.gz WNABTEYWESWNFI-UHFFFAOYSA-N 1 1 345.449 4.378 20 5 EIBDMO C[N@H+]1CC[C@@H](Nc2ccc3ncccc3c2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000534270578 1039282019 /nfs/dbraw/zinc/28/20/19/1039282019.db2.gz BFTGSCCJZZWCRJ-RTBURBONSA-N 1 1 348.406 4.000 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCC12CCCCC2 ZINC000534668140 1039640429 /nfs/dbraw/zinc/64/04/29/1039640429.db2.gz LGCOEMOWHJTQLF-UHFFFAOYSA-N 1 1 345.443 4.031 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000481691678 1039736350 /nfs/dbraw/zinc/73/63/50/1039736350.db2.gz HZAUUISFFIEQRE-YWZLYKJASA-N 1 1 338.407 4.177 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000514244153 1039805841 /nfs/dbraw/zinc/80/58/41/1039805841.db2.gz CXWWEKMDKLFIKQ-QGZVFWFLSA-N 1 1 326.396 4.249 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000430105867 1039846679 /nfs/dbraw/zinc/84/66/79/1039846679.db2.gz OVJDESJKJRXZDP-JVVYVMHDSA-N 1 1 337.423 4.476 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000430105867 1039846682 /nfs/dbraw/zinc/84/66/82/1039846682.db2.gz OVJDESJKJRXZDP-JVVYVMHDSA-N 1 1 337.423 4.476 20 5 EIBDMO CCOc1ccc([C@H]2CCC[N@@H+]2Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000505616229 1040099135 /nfs/dbraw/zinc/09/91/35/1040099135.db2.gz ZCGWERQBAYEXPC-GOSISDBHSA-N 1 1 344.386 4.470 20 5 EIBDMO CCOc1ccc([C@H]2CCC[N@H+]2Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000505616229 1040099149 /nfs/dbraw/zinc/09/91/49/1040099149.db2.gz ZCGWERQBAYEXPC-GOSISDBHSA-N 1 1 344.386 4.470 20 5 EIBDMO CCOc1ccc([C@@H]2CCC[N@@H+]2Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000505616231 1040101256 /nfs/dbraw/zinc/10/12/56/1040101256.db2.gz ZCGWERQBAYEXPC-SFHVURJKSA-N 1 1 344.386 4.470 20 5 EIBDMO CCOc1ccc([C@@H]2CCC[N@H+]2Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000505616231 1040101282 /nfs/dbraw/zinc/10/12/82/1040101282.db2.gz ZCGWERQBAYEXPC-SFHVURJKSA-N 1 1 344.386 4.470 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(OC)c1 ZINC000479575515 1040486015 /nfs/dbraw/zinc/48/60/15/1040486015.db2.gz DKDHBTCLKYROFJ-UHFFFAOYSA-N 1 1 344.411 4.023 20 5 EIBDMO C[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCc2ccccc21 ZINC000089884417 1040493483 /nfs/dbraw/zinc/49/34/83/1040493483.db2.gz ICQKGEGYGHQUNO-IBGZPJMESA-N 1 1 349.390 4.369 20 5 EIBDMO C[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCc2ccccc21 ZINC000089884417 1040493495 /nfs/dbraw/zinc/49/34/95/1040493495.db2.gz ICQKGEGYGHQUNO-IBGZPJMESA-N 1 1 349.390 4.369 20 5 EIBDMO Cn1cc(C[N@H+]2CCCC(C)(C)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000539834984 1040831430 /nfs/dbraw/zinc/83/14/30/1040831430.db2.gz FYMWYWDUKNRMJS-UHFFFAOYSA-N 1 1 342.443 4.007 20 5 EIBDMO CSC[C@H]1CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000539849636 1040838214 /nfs/dbraw/zinc/83/82/14/1040838214.db2.gz IGMZMGCTCUWUBM-OAHLLOKOSA-N 1 1 332.425 4.182 20 5 EIBDMO CC[C@H](NC[C@H]1CCC[N@H+](CC(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000537950556 1040916807 /nfs/dbraw/zinc/91/68/07/1040916807.db2.gz CIDFOVIMDUABCP-APWZRJJASA-N 1 1 333.476 4.004 20 5 EIBDMO CC[C@H](NC[C@H]1CCC[N@@H+](CC(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000537950556 1040916823 /nfs/dbraw/zinc/91/68/23/1040916823.db2.gz CIDFOVIMDUABCP-APWZRJJASA-N 1 1 333.476 4.004 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+][C@@H]2COc3ccc(Cl)cc32)cc1[N+](=O)[O-] ZINC000537956260 1040927289 /nfs/dbraw/zinc/92/72/89/1040927289.db2.gz IYFCMSVXEFRRAX-IAQYHMDHSA-N 1 1 332.787 4.341 20 5 EIBDMO CCC[C@@H]([NH2+]Cc1nc2cc(C)ccc2[nH]1)c1cccc([N+](=O)[O-])c1 ZINC000483851508 1041053690 /nfs/dbraw/zinc/05/36/90/1041053690.db2.gz CSIFZUWJEQWCDF-MRXNPFEDSA-N 1 1 338.411 4.411 20 5 EIBDMO CCC[C@@H]([NH2+]Cc1nc2ccc(C)cc2[nH]1)c1cccc([N+](=O)[O-])c1 ZINC000483851508 1041053706 /nfs/dbraw/zinc/05/37/06/1041053706.db2.gz CSIFZUWJEQWCDF-MRXNPFEDSA-N 1 1 338.411 4.411 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000554745021 1041376551 /nfs/dbraw/zinc/37/65/51/1041376551.db2.gz BXNSONCYQDUDTI-BETUJISGSA-N 1 1 346.349 4.156 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCc1cccs1 ZINC000464764891 1042155006 /nfs/dbraw/zinc/15/50/06/1042155006.db2.gz YCUHWHALLMVDBR-UHFFFAOYSA-N 1 1 334.441 4.118 20 5 EIBDMO CO[C@@]1(C)CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000550000089 1042156347 /nfs/dbraw/zinc/15/63/47/1042156347.db2.gz NVPFCECKBJCCHA-HNNXBMFYSA-N 1 1 346.349 4.005 20 5 EIBDMO C[C@@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@H](c2ccco2)C1 ZINC000464859002 1042202536 /nfs/dbraw/zinc/20/25/36/1042202536.db2.gz PPFNLQCISKCAQE-PBHICJAKSA-N 1 1 330.384 4.040 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(Cc3cccnc3)CC2)c(Cl)c1 ZINC000542046059 1042243239 /nfs/dbraw/zinc/24/32/39/1042243239.db2.gz UZJVPAVPXJHABB-UHFFFAOYSA-N 1 1 345.830 4.098 20 5 EIBDMO CC(C)[N@@H+](C)CCCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491356341 1042431191 /nfs/dbraw/zinc/43/11/91/1042431191.db2.gz LSZOCCPOIWCWPI-FQEVSTJZSA-N 1 1 341.455 4.004 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000491435438 1042446881 /nfs/dbraw/zinc/44/68/81/1042446881.db2.gz URRJZLHJWKBSAP-SPYBWZPUSA-N 1 1 326.396 4.118 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000491435438 1042446886 /nfs/dbraw/zinc/44/68/86/1042446886.db2.gz URRJZLHJWKBSAP-SPYBWZPUSA-N 1 1 326.396 4.118 20 5 EIBDMO CC[C@@H](C)[N@H+](C)CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000518280236 1042450910 /nfs/dbraw/zinc/45/09/10/1042450910.db2.gz WKEAJDFFXNNRAW-CQSZACIVSA-N 1 1 347.484 4.143 20 5 EIBDMO CC[C@@H](C)[N@@H+](C)CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000518280236 1042450913 /nfs/dbraw/zinc/45/09/13/1042450913.db2.gz WKEAJDFFXNNRAW-CQSZACIVSA-N 1 1 347.484 4.143 20 5 EIBDMO CCCc1nc(C)c(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)o1 ZINC000426302089 1042540385 /nfs/dbraw/zinc/54/03/85/1042540385.db2.gz QADFIKKPZYPVQI-INIZCTEOSA-N 1 1 329.400 4.011 20 5 EIBDMO Cc1csc(C2([NH2+][C@H](C)c3cccc([N+](=O)[O-])c3C)CCC2)n1 ZINC000271971343 1042591479 /nfs/dbraw/zinc/59/14/79/1042591479.db2.gz NBFNNRHSLDVNJM-CYBMUJFWSA-N 1 1 331.441 4.398 20 5 EIBDMO CCOc1cc(C[N@H+]2CCC[C@@H]2c2ccsc2)ccc1[N+](=O)[O-] ZINC000492464382 1042660088 /nfs/dbraw/zinc/66/00/88/1042660088.db2.gz SMPRZPUMAOUKLP-OAHLLOKOSA-N 1 1 332.425 4.392 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)Cc1cccc(N(C)C)c1 ZINC000492825149 1042755056 /nfs/dbraw/zinc/75/50/56/1042755056.db2.gz BWASSXPPBCAGNF-OAHLLOKOSA-N 1 1 327.428 4.162 20 5 EIBDMO CC[C@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761515234 1042874761 /nfs/dbraw/zinc/87/47/61/1042874761.db2.gz RXTXNCVXAJUXPF-INIZCTEOSA-N 1 1 348.830 4.021 20 5 EIBDMO CC[C@H]([NH2+]Cc1ccc(F)c(CN(C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000120947177 1043183665 /nfs/dbraw/zinc/18/36/65/1043183665.db2.gz ZEAVJPBVQHKGEC-IBGZPJMESA-N 1 1 345.418 4.036 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCCCC1CCOCC1)C1CC1 ZINC000499552946 1043256633 /nfs/dbraw/zinc/25/66/33/1043256633.db2.gz NZTBVRPUPJDPBU-UHFFFAOYSA-N 1 1 332.444 4.156 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]Cc3ccc(F)cc3)cs2)c1 ZINC000113310953 1043261352 /nfs/dbraw/zinc/26/13/52/1043261352.db2.gz DBEXUECUWJZWOS-UHFFFAOYSA-N 1 1 343.383 4.147 20 5 EIBDMO Cc1ccccc1C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113313935 1043263325 /nfs/dbraw/zinc/26/33/25/1043263325.db2.gz DSKRCRLSEWJSBE-UHFFFAOYSA-N 1 1 339.420 4.317 20 5 EIBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000520882916 1043423860 /nfs/dbraw/zinc/42/38/60/1043423860.db2.gz RDZXKZFRWUVDMA-OKILXGFUSA-N 1 1 330.350 4.190 20 5 EIBDMO CC[NH+](CC)C[C@H](C)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000520959580 1043451232 /nfs/dbraw/zinc/45/12/32/1043451232.db2.gz TXFXKQBLYFZXMQ-AWEZNQCLSA-N 1 1 347.484 4.143 20 5 EIBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1nc2ccc([N+](=O)[O-])cc2s1 ZINC000731206536 1043717189 /nfs/dbraw/zinc/71/71/89/1043717189.db2.gz KWCICDUYKZALLK-CYBMUJFWSA-N 1 1 348.472 4.271 20 5 EIBDMO CC(C)([NH2+]Cc1nc2ccccc2s1)c1ccccc1[N+](=O)[O-] ZINC000429239632 1043840943 /nfs/dbraw/zinc/84/09/43/1043840943.db2.gz VJAKDIANNFBAHG-UHFFFAOYSA-N 1 1 327.409 4.229 20 5 EIBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)c1 ZINC000732988598 1044062537 /nfs/dbraw/zinc/06/25/37/1044062537.db2.gz JJNOEBAHTWWQJB-GOSISDBHSA-N 1 1 348.349 4.089 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC(OC2CCCC2)CC1 ZINC000116274918 1044155658 /nfs/dbraw/zinc/15/56/58/1044155658.db2.gz HJNZNAIRCVIFAN-UHFFFAOYSA-N 1 1 338.835 4.172 20 5 EIBDMO CC(C)([NH2+]Cc1ncccc1C(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000429251409 1044282469 /nfs/dbraw/zinc/28/24/69/1044282469.db2.gz CKOQRNYFXUEYHX-UHFFFAOYSA-N 1 1 339.317 4.034 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+](CC2CC2)C2CCCCC2)c2c(c1)COCO2 ZINC000069079499 1044381259 /nfs/dbraw/zinc/38/12/59/1044381259.db2.gz KBPYZJZMJUOSIH-UHFFFAOYSA-N 1 1 346.427 4.006 20 5 EIBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1c(C)oc2ccccc21 ZINC000466447041 1044489793 /nfs/dbraw/zinc/48/97/93/1044489793.db2.gz WFGHPWWUUBGZLR-UHFFFAOYSA-N 1 1 340.379 4.338 20 5 EIBDMO O=[N+]([O-])c1sccc1NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000142818423 1044490537 /nfs/dbraw/zinc/49/05/37/1044490537.db2.gz WESMGYFWNXUXGZ-GFCCVEGCSA-N 1 1 337.470 4.042 20 5 EIBDMO COC[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000093337699 1044832163 /nfs/dbraw/zinc/83/21/63/1044832163.db2.gz BVRZPLXOAYIEAN-CQSZACIVSA-N 1 1 346.452 4.182 20 5 EIBDMO CCc1onc(C)c1C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000922989122 1044888812 /nfs/dbraw/zinc/88/88/12/1044888812.db2.gz ZHMXYDZSKBIRHF-UHFFFAOYSA-N 1 1 341.367 4.003 20 5 EIBDMO CCC[C@@H](NC[C@H]1CCC[N@@H+](C(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000125868955 1045063594 /nfs/dbraw/zinc/06/35/94/1045063594.db2.gz JAKAEPBKCGJXHA-VQIMIIECSA-N 1 1 333.476 4.146 20 5 EIBDMO CCC[C@@H](NC[C@H]1CCC[N@H+](C(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000125868955 1045063608 /nfs/dbraw/zinc/06/36/08/1045063608.db2.gz JAKAEPBKCGJXHA-VQIMIIECSA-N 1 1 333.476 4.146 20 5 EIBDMO CC1(C)C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCCO1 ZINC000611272458 1045272446 /nfs/dbraw/zinc/27/24/46/1045272446.db2.gz SQLJTMKIVIOFJQ-UHFFFAOYSA-N 1 1 346.452 4.324 20 5 EIBDMO Cc1cc([C@H]([NH2+]Cc2c(F)cccc2[N+](=O)[O-])C2CC2)ccc1F ZINC000611434730 1045308762 /nfs/dbraw/zinc/30/87/62/1045308762.db2.gz ZFOIMKSHNWUEEY-GOSISDBHSA-N 1 1 332.350 4.422 20 5 EIBDMO CCC[N@@H+](Cc1ccc(OC)cc1)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000611515254 1045321489 /nfs/dbraw/zinc/32/14/89/1045321489.db2.gz NJHALMKNXQMOMW-UHFFFAOYSA-N 1 1 344.411 4.024 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cncc3ccccc32)C2CC2)c1 ZINC000768334044 1045791049 /nfs/dbraw/zinc/79/10/49/1045791049.db2.gz JRXVYOWZXCFBTP-UHFFFAOYSA-N 1 1 333.391 4.308 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCO[C@@H](c3ccccc3)C2)ccc1Cl ZINC000768542235 1045817857 /nfs/dbraw/zinc/81/78/57/1045817857.db2.gz RMSPWTWBDASXNJ-GOSISDBHSA-N 1 1 346.814 4.212 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCO[C@@H](c3ccccc3)C2)ccc1Cl ZINC000768542235 1045817853 /nfs/dbraw/zinc/81/78/53/1045817853.db2.gz RMSPWTWBDASXNJ-GOSISDBHSA-N 1 1 346.814 4.212 20 5 EIBDMO COc1ccc([C@H](C)[N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000768543723 1045822910 /nfs/dbraw/zinc/82/29/10/1045822910.db2.gz FPBDTUXRQIPGPJ-LBPRGKRZSA-N 1 1 334.803 4.450 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC4(CCCC4)C3)cs2)c1 ZINC000769396066 1045968192 /nfs/dbraw/zinc/96/81/92/1045968192.db2.gz VMZVSXDYYWNFFI-UHFFFAOYSA-N 1 1 343.452 4.484 20 5 EIBDMO CC[N@@H+](Cc1ccc(F)cc1)[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170353452 1046011295 /nfs/dbraw/zinc/01/12/95/1046011295.db2.gz YJIJSHSLAQIZEJ-CQSZACIVSA-N 1 1 346.402 4.196 20 5 EIBDMO C[C@@H]1OCC[C@@]12C[N@@H+](Cc1c3ccccc3cc3ccccc31)CCO2 ZINC000793230976 1046177384 /nfs/dbraw/zinc/17/73/84/1046177384.db2.gz JADHVZCSERKNQR-GAJHUEQPSA-N 1 1 347.458 4.373 20 5 EIBDMO CC[N@@H+](CCC1CCN(c2cccc(F)c2[N+](=O)[O-])CC1)CC1CC1 ZINC000771283585 1046357439 /nfs/dbraw/zinc/35/74/39/1046357439.db2.gz GTLFREDTRJLETB-UHFFFAOYSA-N 1 1 349.450 4.072 20 5 EIBDMO CC[N@H+]1CC[C@@H](N(C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C[C@H]1C ZINC000536659978 1046626452 /nfs/dbraw/zinc/62/64/52/1046626452.db2.gz QNQDMKRBRJGWBH-NVXWUHKLSA-N 1 1 333.476 4.023 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCS[C@@H]2CCCC[C@H]21 ZINC000752361382 1046626705 /nfs/dbraw/zinc/62/67/05/1046626705.db2.gz XBVKIOVFJWGBDE-HUUCEWRRSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCS[C@@H]2CCCC[C@H]21 ZINC000752361382 1046626720 /nfs/dbraw/zinc/62/67/20/1046626720.db2.gz XBVKIOVFJWGBDE-HUUCEWRRSA-N 1 1 326.849 4.108 20 5 EIBDMO CC[N@H+]1CC[C@H](N(C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000536659979 1046627746 /nfs/dbraw/zinc/62/77/46/1046627746.db2.gz QNQDMKRBRJGWBH-RDJZCZTQSA-N 1 1 333.476 4.023 20 5 EIBDMO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000459670740 1046850468 /nfs/dbraw/zinc/85/04/68/1046850468.db2.gz ULSFZDKBONOCQI-GFCCVEGCSA-N 1 1 334.803 4.416 20 5 EIBDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000746656308 1046923472 /nfs/dbraw/zinc/92/34/72/1046923472.db2.gz XHYGCGVTXJARQO-GFCCVEGCSA-N 1 1 334.803 4.450 20 5 EIBDMO COc1ccc([C@@H](C)[N@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000746656308 1046923457 /nfs/dbraw/zinc/92/34/57/1046923457.db2.gz XHYGCGVTXJARQO-GFCCVEGCSA-N 1 1 334.803 4.450 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000746667111 1046977185 /nfs/dbraw/zinc/97/71/85/1046977185.db2.gz XANUSNJYEJPVNH-SFHVURJKSA-N 1 1 346.814 4.212 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000746667111 1046977203 /nfs/dbraw/zinc/97/72/03/1046977203.db2.gz XANUSNJYEJPVNH-SFHVURJKSA-N 1 1 346.814 4.212 20 5 EIBDMO C[C@H]1C[C@H](c2cccnc2)[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000805749735 1047001431 /nfs/dbraw/zinc/00/14/31/1047001431.db2.gz QZAATMJFDDWHNN-YVEFUNNKSA-N 1 1 331.803 4.226 20 5 EIBDMO C[C@H]1C[C@H](c2cccnc2)[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000805749735 1047001447 /nfs/dbraw/zinc/00/14/47/1047001447.db2.gz QZAATMJFDDWHNN-YVEFUNNKSA-N 1 1 331.803 4.226 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1ccc(Cl)nc1 ZINC000787406746 1047005939 /nfs/dbraw/zinc/00/59/39/1047005939.db2.gz KNMACVJWHNNKTP-JYRVWZFOSA-N 1 1 331.803 4.179 20 5 EIBDMO CC[C@H](c1ccccc1OC)[N@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000805834878 1047024376 /nfs/dbraw/zinc/02/43/76/1047024376.db2.gz JFKBIQLVEJGKAK-MRXNPFEDSA-N 1 1 332.375 4.326 20 5 EIBDMO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000805834878 1047024392 /nfs/dbraw/zinc/02/43/92/1047024392.db2.gz JFKBIQLVEJGKAK-MRXNPFEDSA-N 1 1 332.375 4.326 20 5 EIBDMO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000805835252 1047026009 /nfs/dbraw/zinc/02/60/09/1047026009.db2.gz LXKQMBOLCREOOX-MRXNPFEDSA-N 1 1 332.375 4.326 20 5 EIBDMO Cc1cccc([C@H]2CCC[N@H+]2Cn2ncc3cc([N+](=O)[O-])ccc32)c1 ZINC000917617638 1047027933 /nfs/dbraw/zinc/02/79/33/1047027933.db2.gz NPWHYOALPLPFBX-GOSISDBHSA-N 1 1 336.395 4.048 20 5 EIBDMO CN(C)c1cccc([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)c1 ZINC000788479748 1047198334 /nfs/dbraw/zinc/19/83/34/1047198334.db2.gz AXPRSLOLBAPOMH-GOSISDBHSA-N 1 1 343.402 4.137 20 5 EIBDMO C[C@@H](Nc1ccc([NH+]2CCCCC2)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788690872 1047263567 /nfs/dbraw/zinc/26/35/67/1047263567.db2.gz MJHGNJASEYTPNV-CQSZACIVSA-N 1 1 340.427 4.340 20 5 EIBDMO Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])c1 ZINC000089511878 1047775369 /nfs/dbraw/zinc/77/53/69/1047775369.db2.gz XCISHRGGWMKADK-GFCCVEGCSA-N 1 1 336.338 4.355 20 5 EIBDMO CC[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809644004 1048449892 /nfs/dbraw/zinc/44/98/92/1048449892.db2.gz UOUAWFXNLZVXHB-INIZCTEOSA-N 1 1 348.830 4.021 20 5 EIBDMO C[C@@H]([NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])c1cccc(O)c1 ZINC000809972803 1048593497 /nfs/dbraw/zinc/59/34/97/1048593497.db2.gz ZBERFVAGLYWLOR-SECBINFHSA-N 1 1 341.194 4.458 20 5 EIBDMO COc1ccc(CCC[N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000609705323 1049275630 /nfs/dbraw/zinc/27/56/30/1049275630.db2.gz USJJYYAVPAXVKV-UHFFFAOYSA-N 1 1 348.830 4.321 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCS[C@H](c2ccccc2)C1 ZINC000609800732 1049326991 /nfs/dbraw/zinc/32/69/91/1049326991.db2.gz RFBZKFAYRVANDB-KDOFPFPSSA-N 1 1 328.437 4.446 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(c2ccccc2F)CC1 ZINC000609895459 1049387443 /nfs/dbraw/zinc/38/74/43/1049387443.db2.gz XGBPANLTCARARU-UHFFFAOYSA-N 1 1 332.350 4.253 20 5 EIBDMO Cc1c(C[N@@H+]2C[C@H](c3ccc(F)cc3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000609916543 1049394144 /nfs/dbraw/zinc/39/41/44/1049394144.db2.gz WOKHAKDQRYAPKR-SUMWQHHRSA-N 1 1 328.387 4.420 20 5 EIBDMO COc1ccc(C[N@@H+](C)[C@@H](C)Cc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000609915923 1049395884 /nfs/dbraw/zinc/39/58/84/1049395884.db2.gz WVUCLVRSFIOAMT-ZDUSSCGKSA-N 1 1 348.830 4.320 20 5 EIBDMO COc1ccc(C[N@H+]2C[C@H](c3ccc(F)cc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000609916146 1049398229 /nfs/dbraw/zinc/39/82/29/1049398229.db2.gz AHUVLXNLCDYKHP-CZUORRHYSA-N 1 1 344.386 4.121 20 5 EIBDMO CC[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](C)[C@H](O)c1ccccc1 ZINC000812851312 1049612711 /nfs/dbraw/zinc/61/27/11/1049612711.db2.gz YCJOVMXPRVUHDU-ACJLOTCBSA-N 1 1 348.830 4.192 20 5 EIBDMO CC[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812851315 1049612855 /nfs/dbraw/zinc/61/28/55/1049612855.db2.gz YCJOVMXPRVUHDU-UGSOOPFHSA-N 1 1 348.830 4.192 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCc2ccc(F)cc2[C@@H](C)C1 ZINC001171670383 1049773485 /nfs/dbraw/zinc/77/34/85/1049773485.db2.gz DNZMJQAFRRKAJV-KBPBESRZSA-N 1 1 328.387 4.457 20 5 EIBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[C@H]1c1ccccc1 ZINC001171018509 1049852129 /nfs/dbraw/zinc/85/21/29/1049852129.db2.gz PXPINNOUMNDEAI-VQTJNVASSA-N 1 1 340.423 4.242 20 5 EIBDMO Cc1c(Cl)ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)c1Cl ZINC001177416817 1050209882 /nfs/dbraw/zinc/20/98/82/1050209882.db2.gz XFXZACUCRBHDPE-UHFFFAOYSA-N 1 1 325.195 4.500 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC001173231770 1050358914 /nfs/dbraw/zinc/35/89/14/1050358914.db2.gz CZQSFLRGAXKIFT-PBHICJAKSA-N 1 1 328.387 4.154 20 5 EIBDMO COc1cccc([C@H]2CC[N@H+]([C@H](C)Cc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC001173231933 1050359648 /nfs/dbraw/zinc/35/96/48/1050359648.db2.gz OZKWTDOOHDYGQX-QAPCUYQASA-N 1 1 340.423 4.024 20 5 EIBDMO Cc1cnc(S[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001186757303 1050407366 /nfs/dbraw/zinc/40/73/66/1050407366.db2.gz QIAYLQOOZOXTKA-INIZCTEOSA-N 1 1 343.452 4.055 20 5 EIBDMO CC(C)C[N@@H+](C)CCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001186915756 1050446279 /nfs/dbraw/zinc/44/62/79/1050446279.db2.gz ZIPRVZWDZRHWFL-UHFFFAOYSA-N 1 1 333.354 4.003 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCc2cc(F)ccc2C1 ZINC001180788266 1051078344 /nfs/dbraw/zinc/07/83/44/1051078344.db2.gz VKSURNCPNJTEQK-NTEUORMPSA-N 1 1 326.371 4.196 20 5 EIBDMO C[C@H](c1cccc(Cl)c1)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC001190417543 1051177974 /nfs/dbraw/zinc/17/79/74/1051177974.db2.gz KTRHBJTVKKEMCP-CYBMUJFWSA-N 1 1 334.803 4.320 20 5 EIBDMO CCC[N@@H+](CC1CCCCC1)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC001190484870 1051188286 /nfs/dbraw/zinc/18/82/86/1051188286.db2.gz DJPHRCGUUYWXBN-HNNXBMFYSA-N 1 1 347.459 4.214 20 5 EIBDMO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC ZINC001191037909 1051329825 /nfs/dbraw/zinc/32/98/25/1051329825.db2.gz CBFXZRXAVDFFDP-GOSISDBHSA-N 1 1 326.396 4.113 20 5 EIBDMO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OC ZINC001191037909 1051329838 /nfs/dbraw/zinc/32/98/38/1051329838.db2.gz CBFXZRXAVDFFDP-GOSISDBHSA-N 1 1 326.396 4.113 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](c2ccccc2C)C[C@H]1C ZINC001191156998 1051367661 /nfs/dbraw/zinc/36/76/61/1051367661.db2.gz PQSFKFDYWGRJAV-HZPDHXFCSA-N 1 1 340.423 4.290 20 5 EIBDMO CCC[C@@]1(C)CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC001191258256 1051395820 /nfs/dbraw/zinc/39/58/20/1051395820.db2.gz LRBHXUIIIZMSED-IBGZPJMESA-N 1 1 347.459 4.134 20 5 EIBDMO COc1ccc(C[C@@H]2CC[N@@H+]2Cc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC001191494914 1051466211 /nfs/dbraw/zinc/46/62/11/1051466211.db2.gz BSQJFANXTPLNNX-INIZCTEOSA-N 1 1 346.814 4.074 20 5 EIBDMO COc1ccc(C[C@@H]2CC[N@H+]2Cc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC001191494914 1051466216 /nfs/dbraw/zinc/46/62/16/1051466216.db2.gz BSQJFANXTPLNNX-INIZCTEOSA-N 1 1 346.814 4.074 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](C[C@H]2CC3(CO2)CCCCC3)C2CC2)c1 ZINC001191681515 1051506820 /nfs/dbraw/zinc/50/68/20/1051506820.db2.gz BSCWHYCMVIQPCV-LJQANCHMSA-N 1 1 344.455 4.299 20 5 EIBDMO CC(C)Oc1ccc(-c2cccc([C@@H](C)[N@@H+](C)CC[N+](=O)[O-])c2)cc1 ZINC001192197381 1051653803 /nfs/dbraw/zinc/65/38/03/1051653803.db2.gz GAYQBEBTBSFOCL-MRXNPFEDSA-N 1 1 342.439 4.410 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](OC2CCC2)C1 ZINC001182633986 1051654709 /nfs/dbraw/zinc/65/47/09/1051654709.db2.gz HGBBIQFLFMVFJR-HVEPWOEZSA-N 1 1 330.428 4.032 20 5 EIBDMO Cc1c(NC(=O)CC[N@@H+]2CCCCC[C@@H]2C(C)C)cccc1[N+](=O)[O-] ZINC001192653322 1051781613 /nfs/dbraw/zinc/78/16/13/1051781613.db2.gz MZPLYFXKHCDUCG-QGZVFWFLSA-N 1 1 347.459 4.132 20 5 EIBDMO Cc1cccc([C@H]2CC[N@H+](Cc3c(F)cc([N+](=O)[O-])cc3F)C2)c1 ZINC001193322487 1051899984 /nfs/dbraw/zinc/89/99/84/1051899984.db2.gz BZCJYAATQYATKL-AWEZNQCLSA-N 1 1 332.350 4.171 20 5 EIBDMO Cc1cccc([C@H]2CC[N@@H+](Cc3c(F)cc([N+](=O)[O-])cc3F)C2)c1 ZINC001193322487 1051899986 /nfs/dbraw/zinc/89/99/86/1051899986.db2.gz BZCJYAATQYATKL-AWEZNQCLSA-N 1 1 332.350 4.171 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+](CCc2ccccc2)C2CC2)ccc1Cl ZINC001176414536 1052068106 /nfs/dbraw/zinc/06/81/06/1052068106.db2.gz YJDWEDJGCQIEKF-UHFFFAOYSA-N 1 1 330.815 4.455 20 5 EIBDMO C[C@H](CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1 ZINC001184839440 1052114270 /nfs/dbraw/zinc/11/42/70/1052114270.db2.gz IXXDHQLMLKPSLI-VXGBXAGGSA-N 1 1 345.365 4.146 20 5 EIBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001185037852 1052159152 /nfs/dbraw/zinc/15/91/52/1052159152.db2.gz XMSQSYFEEQPQTM-CJNGLKHVSA-N 1 1 345.830 4.496 20 5 EIBDMO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H](C)c1ccc(F)cc1 ZINC000774845766 1052206962 /nfs/dbraw/zinc/20/69/62/1052206962.db2.gz KWAXXJFEWCTENJ-LBPRGKRZSA-N 1 1 347.346 4.225 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H](C)c1ccc(F)cc1 ZINC000774845766 1052206973 /nfs/dbraw/zinc/20/69/73/1052206973.db2.gz KWAXXJFEWCTENJ-LBPRGKRZSA-N 1 1 347.346 4.225 20 5 EIBDMO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083133432 1052833159 /nfs/dbraw/zinc/83/31/59/1052833159.db2.gz QEERRBPVAWPEKG-SNVBAGLBSA-N 1 1 347.321 4.207 20 5 EIBDMO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083133432 1052833161 /nfs/dbraw/zinc/83/31/61/1052833161.db2.gz QEERRBPVAWPEKG-SNVBAGLBSA-N 1 1 347.321 4.207 20 5 EIBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H](C)c1ccc(F)cc1 ZINC000083168777 1052841999 /nfs/dbraw/zinc/84/19/99/1052841999.db2.gz ZEWSLYBZCNLPHE-LBPRGKRZSA-N 1 1 343.358 4.458 20 5 EIBDMO C[C@H]1C[C@@H](C(C)(C)C)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001194807732 1053107677 /nfs/dbraw/zinc/10/76/77/1053107677.db2.gz SYHXDVPNABPRAG-GJZGRUSLSA-N 1 1 347.459 4.070 20 5 EIBDMO Cc1c(CNc2ccc3c(c2)[nH+]c(C2CC2)n3C)cccc1[N+](=O)[O-] ZINC000864021132 1053154109 /nfs/dbraw/zinc/15/41/09/1053154109.db2.gz HSMDQGJXIFXFSV-UHFFFAOYSA-N 1 1 336.395 4.279 20 5 EIBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccc2c(c1)CCCO2 ZINC000850444358 1053218568 /nfs/dbraw/zinc/21/85/68/1053218568.db2.gz ITGAYHVXSYAHPJ-GFCCVEGCSA-N 1 1 346.814 4.424 20 5 EIBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@H]1CCC[C@H]1c1ccccc1 ZINC001195022852 1053230855 /nfs/dbraw/zinc/23/08/55/1053230855.db2.gz OSSXOIYDHYKVFU-ROUUACIJSA-N 1 1 340.423 4.242 20 5 EIBDMO COc1cccc([C@H]2C[C@H]([N@@H+](C)Cc3cccc([N+](=O)[O-])c3C)C2)c1 ZINC001195083672 1053264036 /nfs/dbraw/zinc/26/40/36/1053264036.db2.gz FGKMGDYKXCARID-IYARVYRRSA-N 1 1 340.423 4.290 20 5 EIBDMO COc1cc(C[N@@H+](C)[C@@H]2CCC[C@@H]2C(C)(C)C)c([N+](=O)[O-])cc1F ZINC001195279894 1053358884 /nfs/dbraw/zinc/35/88/84/1053358884.db2.gz PNCQHIXZSQNDTQ-DZGCQCFKSA-N 1 1 338.423 4.389 20 5 EIBDMO C[C@H]([NH2+]Cc1cccc(F)c1OC(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000852095679 1053549612 /nfs/dbraw/zinc/54/96/12/1053549612.db2.gz CQOMPPBLXMZBQL-JTQLQIEISA-N 1 1 340.301 4.186 20 5 EIBDMO CC[C@H](c1ccccc1)[N@@H+](CC)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580274 1053563418 /nfs/dbraw/zinc/56/34/18/1053563418.db2.gz RWGKIXYCYSAHIX-RTBURBONSA-N 1 1 328.412 4.101 20 5 EIBDMO CC[C@@H](c1ccccc1)[N@@H+](CC)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580273 1053563534 /nfs/dbraw/zinc/56/35/34/1053563534.db2.gz RWGKIXYCYSAHIX-RBUKOAKNSA-N 1 1 328.412 4.101 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]([C@@H]3CCCCO3)C2)ccc1Cl ZINC000852595546 1053593878 /nfs/dbraw/zinc/59/38/78/1053593878.db2.gz IGDIZJNUDQEIIM-PBHICJAKSA-N 1 1 338.835 4.029 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@@H]([C@H]2CCCCO2)C1 ZINC000852594171 1053594216 /nfs/dbraw/zinc/59/42/16/1053594216.db2.gz AGQZIPXNMOTSDV-CXAGYDPISA-N 1 1 338.835 4.029 20 5 EIBDMO Cc1cncc([C@@H]2CCCN2c2cc[nH+]c3ccc([N+](=O)[O-])cc32)c1 ZINC000866275377 1053673112 /nfs/dbraw/zinc/67/31/12/1053673112.db2.gz AHUVKOXDSBURKI-SFHVURJKSA-N 1 1 334.379 4.188 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](N(C)c2ccccc2)C1 ZINC001196505717 1053686864 /nfs/dbraw/zinc/68/68/64/1053686864.db2.gz FRAZSLIGWCYGGP-APWZRJJASA-N 1 1 339.439 4.175 20 5 EIBDMO COC[C@H](C)[N@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1CCc2ccccc21 ZINC001196646029 1053710997 /nfs/dbraw/zinc/71/09/97/1053710997.db2.gz FKNNJLXVDOKOEM-SUMWQHHRSA-N 1 1 346.452 4.181 20 5 EIBDMO COC[C@H](C)[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1CCc2ccccc21 ZINC001196646029 1053711005 /nfs/dbraw/zinc/71/10/05/1053711005.db2.gz FKNNJLXVDOKOEM-SUMWQHHRSA-N 1 1 346.452 4.181 20 5 EIBDMO Cn1ccnc1[C@@H]([NH2+]CCCCC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000552249641 1053842082 /nfs/dbraw/zinc/84/20/82/1053842082.db2.gz GSBBNIZMMWZQSG-KRWDZBQOSA-N 1 1 344.459 4.224 20 5 EIBDMO C[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])cc2F)[C@@H]1c1cccs1 ZINC000301427590 1053926208 /nfs/dbraw/zinc/92/62/08/1053926208.db2.gz PLKQTCYXFUCXKV-YVEFUNNKSA-N 1 1 349.431 4.290 20 5 EIBDMO C[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])cc2)[C@H]1c1cccs1 ZINC000301428397 1054025632 /nfs/dbraw/zinc/02/56/32/1054025632.db2.gz PSGMHJWUWKUZMX-DYVFJYSZSA-N 1 1 331.441 4.151 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1/C=C\c1ccccc1 ZINC001198271602 1054120475 /nfs/dbraw/zinc/12/04/75/1054120475.db2.gz XFYSQXINYZDZFB-LPADLIQXSA-N 1 1 338.407 4.281 20 5 EIBDMO Cc1ccc(C[N@H+]2CCCC[C@H]2Cc2ccc(O)cc2)cc1[N+](=O)[O-] ZINC001198605171 1054203409 /nfs/dbraw/zinc/20/34/09/1054203409.db2.gz XVMONWBAXMGWFV-SFHVURJKSA-N 1 1 340.423 4.206 20 5 EIBDMO CC[C@@H](C[N@@H+](CC)C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000775895279 1054279214 /nfs/dbraw/zinc/27/92/14/1054279214.db2.gz KZCBEYIBUICLPJ-OXJNMPFZSA-N 1 1 342.439 4.144 20 5 EIBDMO C[C@@H]([NH2+][C@@H]1CSCc2ccccc21)c1c(F)cccc1[N+](=O)[O-] ZINC000872029529 1054346099 /nfs/dbraw/zinc/34/60/99/1054346099.db2.gz RGFNEPJJAKBNQN-IAQYHMDHSA-N 1 1 332.400 4.373 20 5 EIBDMO C[C@@H]([NH2+][C@H]1CCCOc2ccccc21)c1c(F)cccc1[N+](=O)[O-] ZINC000872031289 1054347802 /nfs/dbraw/zinc/34/78/02/1054347802.db2.gz NWNDPBTXKPYPIZ-DOMZBBRYSA-N 1 1 330.359 4.298 20 5 EIBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000872046811 1054360530 /nfs/dbraw/zinc/36/05/30/1054360530.db2.gz LZZYTNYWCIFCSS-LLVKDONJSA-N 1 1 347.396 4.076 20 5 EIBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc(Cl)cn1 ZINC000872054330 1054364519 /nfs/dbraw/zinc/36/45/19/1054364519.db2.gz TWZZYKWTVXBRIS-SNVBAGLBSA-N 1 1 337.832 4.216 20 5 EIBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)c1cncc(F)c1 ZINC000872059077 1054368788 /nfs/dbraw/zinc/36/87/88/1054368788.db2.gz ASRDWMXVEJTGPX-WDEREUQCSA-N 1 1 335.404 4.263 20 5 EIBDMO C[C@H](N[C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872060564 1054370668 /nfs/dbraw/zinc/37/06/68/1054370668.db2.gz RAVAHPHTKNTQMY-SOUVJXGZSA-N 1 1 349.450 4.038 20 5 EIBDMO CCc1nc(C)c(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2SC)o1 ZINC000872072757 1054379626 /nfs/dbraw/zinc/37/96/26/1054379626.db2.gz JNPHFBQDUABZRZ-SNVBAGLBSA-N 1 1 335.429 4.026 20 5 EIBDMO COc1cc(F)c([C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000173416701 1054895821 /nfs/dbraw/zinc/89/58/21/1054895821.db2.gz HUYYMZJCGIKCPN-NEPJUHHUSA-N 1 1 348.374 4.163 20 5 EIBDMO CC(C)(C)c1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)s1 ZINC000877805367 1055123494 /nfs/dbraw/zinc/12/34/94/1055123494.db2.gz MFFSTPANMSZEOT-UHFFFAOYSA-N 1 1 345.424 4.385 20 5 EIBDMO CCCCC[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C(C)C ZINC000877955887 1055162273 /nfs/dbraw/zinc/16/22/73/1055162273.db2.gz GFCVBEKGEYLXLJ-UHFFFAOYSA-N 1 1 332.404 4.045 20 5 EIBDMO CCC1CCC([N@@H+](C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000878165394 1055197687 /nfs/dbraw/zinc/19/76/87/1055197687.db2.gz XZYNXIBHZNYGEV-UHFFFAOYSA-N 1 1 344.415 4.045 20 5 EIBDMO CC(C)CC[C@@H]1CCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878199566 1055204293 /nfs/dbraw/zinc/20/42/93/1055204293.db2.gz CUMLDSJUGZFWJI-AWEZNQCLSA-N 1 1 344.415 4.045 20 5 EIBDMO C[N@H+]1CCC[C@@H](CNc2ccc(F)cc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000301452234 1055219084 /nfs/dbraw/zinc/21/90/84/1055219084.db2.gz XSKIKSHZIURAJH-SJCJKPOMSA-N 1 1 349.431 4.290 20 5 EIBDMO C[C@H](NC[C@@H](c1ccccc1)[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000326784562 1055519587 /nfs/dbraw/zinc/51/95/87/1055519587.db2.gz VLOMTXCGWPJHDY-JXFKEZNVSA-N 1 1 339.439 4.083 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Nc1cccc(F)c1[N+](=O)[O-] ZINC000301588416 1055743915 /nfs/dbraw/zinc/74/39/15/1055743915.db2.gz PUUBGFJKUXNFAZ-PBHICJAKSA-N 1 1 343.402 4.056 20 5 EIBDMO CCC(CC)C[N@@H+](CC)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000153879618 1056689318 /nfs/dbraw/zinc/68/93/18/1056689318.db2.gz KNTUYWHPCUMPQV-ZDUSSCGKSA-N 1 1 346.431 4.464 20 5 EIBDMO C[N@@H+](CCc1cccs1)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000743382336 1058963253 /nfs/dbraw/zinc/96/32/53/1058963253.db2.gz PCYXFVZLTMHDEK-UHFFFAOYSA-N 1 1 349.437 4.065 20 5 EIBDMO Cc1nn(C[N@@H+]2CCCC[C@H]2c2cccc(C)c2C)c(C)c1[N+](=O)[O-] ZINC000743386927 1058970826 /nfs/dbraw/zinc/97/08/26/1058970826.db2.gz BEDCESQIEYFECP-SFHVURJKSA-N 1 1 342.443 4.210 20 5 EIBDMO Cc1nn(C[N@H+]2CCCC[C@H]2c2cccc(C)c2C)c(C)c1[N+](=O)[O-] ZINC000743386927 1058970853 /nfs/dbraw/zinc/97/08/53/1058970853.db2.gz BEDCESQIEYFECP-SFHVURJKSA-N 1 1 342.443 4.210 20 5 EIBDMO CC[N@@H+](Cc1ccc(Cl)cc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000746033862 1059973742 /nfs/dbraw/zinc/97/37/42/1059973742.db2.gz WGMUXCIUXNNKEY-UHFFFAOYSA-N 1 1 344.802 4.078 20 5 EIBDMO CC[N@H+](Cc1ccc(Cl)cc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000746033862 1059973773 /nfs/dbraw/zinc/97/37/73/1059973773.db2.gz WGMUXCIUXNNKEY-UHFFFAOYSA-N 1 1 344.802 4.078 20 5 EIBDMO COc1ccc2c(c1)CCC[C@@H]2[N@@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000746140550 1060038727 /nfs/dbraw/zinc/03/87/27/1060038727.db2.gz NBBZIMQIKPNYEE-FQEVSTJZSA-N 1 1 340.423 4.421 20 5 EIBDMO C[C@@]1(Cc2ccccc2)CCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC001168967986 1060562708 /nfs/dbraw/zinc/56/27/08/1060562708.db2.gz CNYGAIQBSMRECL-FQEVSTJZSA-N 1 1 340.423 4.071 20 5 EIBDMO CC[N@@H+](Cc1ccc(Cl)cc1Cl)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169044844 1060599195 /nfs/dbraw/zinc/59/91/95/1060599195.db2.gz JCJIIPKWIZCECD-BXUZGUMPSA-N 1 1 331.243 4.261 20 5 EIBDMO C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c3c2CC[N@H+](C)C3)c2ccccc21 ZINC001169379956 1060791533 /nfs/dbraw/zinc/79/15/33/1060791533.db2.gz PAMIRJOYZRZLTE-BFUOFWGJSA-N 1 1 337.423 4.243 20 5 EIBDMO C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c3c2CC[N@@H+](C)C3)c2ccccc21 ZINC001169379956 1060791549 /nfs/dbraw/zinc/79/15/49/1060791549.db2.gz PAMIRJOYZRZLTE-BFUOFWGJSA-N 1 1 337.423 4.243 20 5 EIBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCCCC[C@@H]1/C=C/c1ccccc1 ZINC001168144169 1032210328 /nfs/dbraw/zinc/21/03/28/1032210328.db2.gz BYJPRQZWGTYQCZ-JXOMPUQVSA-N 1 1 337.423 4.448 20 5 EIBDMO CC[C@H]([NH2+]Cc1cccnc1OC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000324600266 1032317888 /nfs/dbraw/zinc/31/78/88/1032317888.db2.gz LOYBVKKFEUKKHS-KRWDZBQOSA-N 1 1 329.400 4.018 20 5 EIBDMO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CC1 ZINC000532963254 1032414008 /nfs/dbraw/zinc/41/40/08/1032414008.db2.gz BKXFERBNNMMWJQ-CHWSQXEVSA-N 1 1 344.415 4.044 20 5 EIBDMO COc1ccc2cc(C[N@@H+](C)Cc3ccccc3[N+](=O)[O-])ccc2c1 ZINC000015370296 1032838959 /nfs/dbraw/zinc/83/89/59/1032838959.db2.gz CKBLLPUZLVDMTD-UHFFFAOYSA-N 1 1 336.391 4.389 20 5 EIBDMO Cc1ccccc1OCCC[N@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC001167083193 1019717470 /nfs/dbraw/zinc/71/74/70/1019717470.db2.gz BQHGSLLBJZNYPQ-UHFFFAOYSA-N 1 1 348.830 4.458 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CC[C@H]3c3ccccc3)o2)c1 ZINC000471188475 1019736191 /nfs/dbraw/zinc/73/61/91/1019736191.db2.gz WEJAXFFJGHBKMN-SFHVURJKSA-N 1 1 349.390 4.239 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1Br)[C@H](C)C(C)C ZINC001167240829 1020648445 /nfs/dbraw/zinc/64/84/45/1020648445.db2.gz LHIBGTZAKPACNN-LLVKDONJSA-N 1 1 329.238 4.224 20 5 EIBDMO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083168913 1021021475 /nfs/dbraw/zinc/02/14/75/1021021475.db2.gz VWEGWJMNKSTQIM-KRWDZBQOSA-N 1 1 337.379 4.382 20 5 EIBDMO C[C@H](NCC[C@H](C)[N@@H+](C)Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000379624338 1021845759 /nfs/dbraw/zinc/84/57/59/1021845759.db2.gz JNFDVRMFDKRYKF-IRXDYDNUSA-N 1 1 341.455 4.156 20 5 EIBDMO Cn1cc(C[N@@H+]2CCCCC[C@@H]2c2ccc(Cl)cc2)c([N+](=O)[O-])n1 ZINC001167406007 1022062489 /nfs/dbraw/zinc/06/24/89/1022062489.db2.gz MGUHQUCKZCLFND-MRXNPFEDSA-N 1 1 348.834 4.099 20 5 EIBDMO Cn1cc(C[N@H+]2CCCCC[C@@H]2c2ccc(Cl)cc2)c([N+](=O)[O-])n1 ZINC001167406007 1022062501 /nfs/dbraw/zinc/06/25/01/1022062501.db2.gz MGUHQUCKZCLFND-MRXNPFEDSA-N 1 1 348.834 4.099 20 5 EIBDMO COCCCC[N@H+](Cc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000103470025 1022373705 /nfs/dbraw/zinc/37/37/05/1022373705.db2.gz BWDNEKDDAHKXSC-UHFFFAOYSA-N 1 1 346.402 4.163 20 5 EIBDMO COCCCC[N@@H+](Cc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000103470025 1022373724 /nfs/dbraw/zinc/37/37/24/1022373724.db2.gz BWDNEKDDAHKXSC-UHFFFAOYSA-N 1 1 346.402 4.163 20 5 EIBDMO CC(C)[N@@H+](Cc1cccs1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610580975 1023217700 /nfs/dbraw/zinc/21/77/00/1023217700.db2.gz QPWLVFWWMWUOTP-UHFFFAOYSA-N 1 1 331.397 4.208 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1noc3ccccc13)CCCC2 ZINC000581439262 1023221599 /nfs/dbraw/zinc/22/15/99/1023221599.db2.gz PEYQIYIJBPDHAX-KRWDZBQOSA-N 1 1 337.379 4.293 20 5 EIBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccnn1CC1CCC1 ZINC000925690506 1023761731 /nfs/dbraw/zinc/76/17/31/1023761731.db2.gz GSGOGRQJMJHUDD-KBPBESRZSA-N 1 1 328.416 4.003 20 5 EIBDMO CC[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccc(C)cc1 ZINC000181691990 1023962717 /nfs/dbraw/zinc/96/27/17/1023962717.db2.gz CUOQZBXRDAIPPZ-HNNXBMFYSA-N 1 1 325.368 4.285 20 5 EIBDMO CC(C)[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1CCCC1 ZINC000108364431 1024034186 /nfs/dbraw/zinc/03/41/86/1024034186.db2.gz KOXWCQOOJIGMLZ-UHFFFAOYSA-N 1 1 343.427 4.445 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCCOc2cc(Cl)ccc21 ZINC000341803516 1024724427 /nfs/dbraw/zinc/72/44/27/1024724427.db2.gz IRFVNMWTWPOGEV-HNNXBMFYSA-N 1 1 332.787 4.252 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](Cc1ccc(C)s1)C(C)C ZINC000065162115 1025055241 /nfs/dbraw/zinc/05/52/41/1025055241.db2.gz JWKHVICETYLLNW-UHFFFAOYSA-N 1 1 334.441 4.384 20 5 EIBDMO CCc1ccc([C@@H](COC)[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)o1 ZINC000165261068 1025175430 /nfs/dbraw/zinc/17/54/30/1025175430.db2.gz UUDDCRDPKDRPQK-CXAGYDPISA-N 1 1 332.400 4.097 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(OC3CCCC3)cc2)c(F)c1 ZINC000585743525 1025812486 /nfs/dbraw/zinc/81/24/86/1025812486.db2.gz FRCHDGCKFDWGCZ-UHFFFAOYSA-N 1 1 344.386 4.345 20 5 EIBDMO CC[N@@H+](C[C@@H](O)c1ccc(C)cc1)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC001167517886 1025898743 /nfs/dbraw/zinc/89/87/43/1025898743.db2.gz SKVSTZQXNXJRSJ-OXQOHEQNSA-N 1 1 342.439 4.328 20 5 EIBDMO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC001167533466 1025962630 /nfs/dbraw/zinc/96/26/30/1025962630.db2.gz DGBKNBXCNGTUKO-PHIMTYICSA-N 1 1 327.222 4.120 20 5 EIBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC001167533466 1025962650 /nfs/dbraw/zinc/96/26/50/1025962650.db2.gz DGBKNBXCNGTUKO-PHIMTYICSA-N 1 1 327.222 4.120 20 5 EIBDMO CC1(C)C[C@H]([NH2+]Cc2nc(C3CC3)cs2)c2cc([N+](=O)[O-])ccc21 ZINC000279064090 1026039356 /nfs/dbraw/zinc/03/93/56/1026039356.db2.gz LDQBQNSTAQWJIA-HNNXBMFYSA-N 1 1 343.452 4.441 20 5 EIBDMO CO[C@H](C[N@@H+](C)CCc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000511068307 1026104611 /nfs/dbraw/zinc/10/46/11/1026104611.db2.gz ZJENGMYDZGQPNI-GOSISDBHSA-N 1 1 348.830 4.110 20 5 EIBDMO Cc1c(C[N@H+](Cc2cccs2)C[C@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000051429684 1026140192 /nfs/dbraw/zinc/14/01/92/1026140192.db2.gz ZYWIHQMIUGQRNK-MRXNPFEDSA-N 1 1 346.452 4.146 20 5 EIBDMO CC1CCC([N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000551392396 1026168019 /nfs/dbraw/zinc/16/80/19/1026168019.db2.gz AJYQGLLTXWHGNX-UHFFFAOYSA-N 1 1 329.400 4.260 20 5 EIBDMO CCCC[N@@H+](Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)[C@H](C)CC ZINC000728898070 1026236379 /nfs/dbraw/zinc/23/63/79/1026236379.db2.gz VOOGWCNVTBPTGJ-OAHLLOKOSA-N 1 1 330.432 4.316 20 5 EIBDMO CC(C)(C)OC1CC([N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000451551721 1026367720 /nfs/dbraw/zinc/36/77/20/1026367720.db2.gz UUHJRDMPSOSLPT-ZLPCBKJTSA-N 1 1 332.444 4.120 20 5 EIBDMO CC(C)(C)CCOc1cnccc1C[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000582264162 1026383921 /nfs/dbraw/zinc/38/39/21/1026383921.db2.gz XJOWNWBACGNJRW-UHFFFAOYSA-N 1 1 343.427 4.095 20 5 EIBDMO COc1ccc(C[N@H+](Cc2ccccc2F)C(C)C)cc1[N+](=O)[O-] ZINC000507160779 1026669801 /nfs/dbraw/zinc/66/98/01/1026669801.db2.gz NHLUIBRRKNXHII-UHFFFAOYSA-N 1 1 332.375 4.153 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2ccccc2F)C(C)C)cc1[N+](=O)[O-] ZINC000507160779 1026669808 /nfs/dbraw/zinc/66/98/08/1026669808.db2.gz NHLUIBRRKNXHII-UHFFFAOYSA-N 1 1 332.375 4.153 20 5 EIBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)CCc1cccc2ccccc21 ZINC000507279651 1026731008 /nfs/dbraw/zinc/73/10/08/1026731008.db2.gz OQWKJTLYZKBLDO-UHFFFAOYSA-N 1 1 334.419 4.465 20 5 EIBDMO COc1ccc([C@H]2CC[N@@H+](C/C=C\c3ccccc3[N+](=O)[O-])C2)cc1 ZINC000512339359 1026739151 /nfs/dbraw/zinc/73/91/51/1026739151.db2.gz UMSLFHLANMFLBP-SUZKBHRPSA-N 1 1 338.407 4.106 20 5 EIBDMO C[C@H]1CC[C@]2(CC[N@@H+](Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)C2)C1 ZINC000543808045 1026865436 /nfs/dbraw/zinc/86/54/36/1026865436.db2.gz NTGAFLJAQDHHDM-LIRRHRJNSA-N 1 1 341.411 4.262 20 5 EIBDMO C[C@@H]([NH2+][C@@H](CN1CCCC1)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000178642316 1026971251 /nfs/dbraw/zinc/97/12/51/1026971251.db2.gz FBVWDCRFHBAJAG-UZLBHIALSA-N 1 1 339.439 4.083 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H](C)C[C@@H]1c1cccc(F)c1 ZINC000441325897 1027460703 /nfs/dbraw/zinc/46/07/03/1027460703.db2.gz UKVJDOBPDLIDKC-FZKQIMNGSA-N 1 1 344.386 4.326 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](C)C[C@@H]1c1cccc(F)c1 ZINC000441325897 1027460712 /nfs/dbraw/zinc/46/07/12/1027460712.db2.gz UKVJDOBPDLIDKC-FZKQIMNGSA-N 1 1 344.386 4.326 20 5 EIBDMO CC[C@H](N[C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000248397846 1028095455 /nfs/dbraw/zinc/09/54/55/1028095455.db2.gz IGYKZUOQMAWHLY-KNBMTAEXSA-N 1 1 345.487 4.289 20 5 EIBDMO CC[C@H](N[C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000248397846 1028095477 /nfs/dbraw/zinc/09/54/77/1028095477.db2.gz IGYKZUOQMAWHLY-KNBMTAEXSA-N 1 1 345.487 4.289 20 5 EIBDMO COCc1ccc([C@@H]2CCC[N@@H+]2[C@@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000248619035 1028606395 /nfs/dbraw/zinc/60/63/95/1028606395.db2.gz LULVYIKVEXGXGS-GUYCJALGSA-N 1 1 330.384 4.232 20 5 EIBDMO COCc1ccc([C@@H]2CCC[N@H+]2[C@@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000248619035 1028606425 /nfs/dbraw/zinc/60/64/25/1028606425.db2.gz LULVYIKVEXGXGS-GUYCJALGSA-N 1 1 330.384 4.232 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCCC4(CCCC4)C3)co2)cc1 ZINC000445874372 1028981644 /nfs/dbraw/zinc/98/16/44/1028981644.db2.gz JDLMMHUXZNZBMD-UHFFFAOYSA-N 1 1 341.411 4.406 20 5 EIBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccc2ccccc2c1 ZINC000052689519 1029390594 /nfs/dbraw/zinc/39/05/94/1029390594.db2.gz KWFFXEHEBMVJFN-UHFFFAOYSA-N 1 1 346.390 4.256 20 5 EIBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccc2ccccc2c1 ZINC000052689519 1029390618 /nfs/dbraw/zinc/39/06/18/1029390618.db2.gz KWFFXEHEBMVJFN-UHFFFAOYSA-N 1 1 346.390 4.256 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3cccnc3)CC2)c(Cl)c1 ZINC000611796161 1029425296 /nfs/dbraw/zinc/42/52/96/1029425296.db2.gz HQSCFEXJSFAPBF-UHFFFAOYSA-N 1 1 331.803 4.023 20 5 EIBDMO Cc1[nH+]c2cc(Nc3ccc4ncccc4c3[N+](=O)[O-])ccc2n1C ZINC000525191660 1029504567 /nfs/dbraw/zinc/50/45/67/1029504567.db2.gz SKCYJHYZSJLACZ-UHFFFAOYSA-N 1 1 333.351 4.082 20 5 EIBDMO CC(C)O[C@@H](C[N@@H+](C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000428452552 1029550237 /nfs/dbraw/zinc/55/02/37/1029550237.db2.gz LYNHSWUJUWBITL-IBGZPJMESA-N 1 1 328.412 4.193 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@H](c2ccncc2)C1 ZINC000451009126 1030173353 /nfs/dbraw/zinc/17/33/53/1030173353.db2.gz ZJXQXLQJNOOSEL-AWEZNQCLSA-N 1 1 331.803 4.023 20 5 EIBDMO CO[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000611984085 1030707645 /nfs/dbraw/zinc/70/76/45/1030707645.db2.gz CLVHWGPGQUXLHM-AWEZNQCLSA-N 1 1 346.452 4.324 20 5 EIBDMO CC(C)[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CC(C)(C)C1 ZINC000452099644 1030831303 /nfs/dbraw/zinc/83/13/03/1030831303.db2.gz CWDCJJZFZXAFSV-UHFFFAOYSA-N 1 1 344.415 4.044 20 5 EIBDMO CC(C)[C@@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCCO1 ZINC000575890441 1031336878 /nfs/dbraw/zinc/33/68/78/1031336878.db2.gz RFGNKPXSQSFYBC-IBGZPJMESA-N 1 1 344.411 4.102 20 5 EIBDMO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001168234565 1031388624 /nfs/dbraw/zinc/38/86/24/1031388624.db2.gz MKRSJDUYFRWZKI-KGLIPLIRSA-N 1 1 344.386 4.121 20 5 EIBDMO C[C@@H]([NH2+][C@H]1CCc2cc(F)c(F)c(F)c21)c1cccc([N+](=O)[O-])c1 ZINC000449087644 1031450013 /nfs/dbraw/zinc/45/00/13/1031450013.db2.gz GTLASYYPSVKION-OTYXRUKQSA-N 1 1 336.313 4.350 20 5 EIBDMO CC(C)(C)Oc1cc(N2CCC[N@H+](C(C)(C)C)CC2)ccc1[N+](=O)[O-] ZINC000536537977 1031589131 /nfs/dbraw/zinc/58/91/31/1031589131.db2.gz DDLDTCWGLFWXGL-UHFFFAOYSA-N 1 1 349.475 4.083 20 5 EIBDMO C[C@@H]1C[C@H](C(F)(F)F)CC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000449461149 1031779647 /nfs/dbraw/zinc/77/96/47/1031779647.db2.gz OPXPJAARBXVYJX-FAQJLRJSSA-N 1 1 328.334 4.271 20 5 EIBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@@H]1C ZINC000449493558 1031789534 /nfs/dbraw/zinc/78/95/34/1031789534.db2.gz FCEZFZBTXWDNNO-GUYCJALGSA-N 1 1 346.452 4.180 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@H]3C3CCC3)cs2)c1 ZINC000512621667 1033516562 /nfs/dbraw/zinc/51/65/62/1033516562.db2.gz ARMIBGMYCDVKHX-KRWDZBQOSA-N 1 1 343.452 4.483 20 5 EIBDMO Cc1csc([C@H](C)[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)n1 ZINC000433169662 1033975743 /nfs/dbraw/zinc/97/57/43/1033975743.db2.gz YBOMYEYUXVCOSC-NHYWBVRUSA-N 1 1 331.441 4.433 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccc(C)cc1SC ZINC000595022796 1035510371 /nfs/dbraw/zinc/51/03/71/1035510371.db2.gz WKPAAQIUXCEROK-ZDUSSCGKSA-N 1 1 346.452 4.485 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](c1ncccc1C)C(C)C ZINC000595007722 1035531626 /nfs/dbraw/zinc/53/16/26/1035531626.db2.gz IXMKGUQPHQNQCL-KSSFIOAISA-N 1 1 343.427 4.355 20 5 EIBDMO CC[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC)c1c(C)noc1C ZINC000595035766 1035561134 /nfs/dbraw/zinc/56/11/34/1035561134.db2.gz MFGKLJIKANYQNP-ZUZCIYMTSA-N 1 1 333.388 4.010 20 5 EIBDMO Cc1cc(N[C@H](Cc2[nH+]ccn2C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000078558764 1035611638 /nfs/dbraw/zinc/61/16/38/1035611638.db2.gz OKMQNQPPHYPEEY-QGZVFWFLSA-N 1 1 336.395 4.033 20 5 EIBDMO Cc1noc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2C[C@H]2C)c1[N+](=O)[O-] ZINC000595424398 1035675172 /nfs/dbraw/zinc/67/51/72/1035675172.db2.gz MDELOOKHJBMKFV-ZDBHGNHJSA-N 1 1 335.791 4.032 20 5 EIBDMO Cc1noc(C[N@H+]2C[C@H](c3ccccc3)[C@H]3CCCC[C@H]32)c1[N+](=O)[O-] ZINC000595450214 1035682183 /nfs/dbraw/zinc/68/21/83/1035682183.db2.gz SFKNCUZVQMTHAE-BRWVUGGUSA-N 1 1 341.411 4.049 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H]3O[C@H](c4ccccc4)C[C@@H]32)c1 ZINC000593124885 1035795852 /nfs/dbraw/zinc/79/58/52/1035795852.db2.gz KJEACXTWCZFRFS-UFYCRDLUSA-N 1 1 338.407 4.089 20 5 EIBDMO CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000595858181 1035800971 /nfs/dbraw/zinc/80/09/71/1035800971.db2.gz SFODRLGYAYVLQY-MYFMFCSTSA-N 1 1 327.384 4.013 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]3O[C@H](c4ccccc4)C[C@@H]32)cc1 ZINC000593126570 1035806911 /nfs/dbraw/zinc/80/69/11/1035806911.db2.gz WMJPHVUGZYTBTK-UFYCRDLUSA-N 1 1 338.407 4.089 20 5 EIBDMO COc1cc(C[N@@H+](C)[C@@H](C)c2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000485736121 1036227550 /nfs/dbraw/zinc/22/75/50/1036227550.db2.gz HDAVHYRCYRKJRF-LBPRGKRZSA-N 1 1 334.803 4.450 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccc(C(F)F)nc2)C2CC2)cc1 ZINC000602438634 1036447654 /nfs/dbraw/zinc/44/76/54/1036447654.db2.gz GVQMQJPKLXHTJI-UHFFFAOYSA-N 1 1 333.338 4.092 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc(C(F)F)nc2)C2CC2)cc1 ZINC000602438634 1036447665 /nfs/dbraw/zinc/44/76/65/1036447665.db2.gz GVQMQJPKLXHTJI-UHFFFAOYSA-N 1 1 333.338 4.092 20 5 EIBDMO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1nc3cc([N+](=O)[O-])ccc3o1)[C@H](C)C2 ZINC000602601699 1036524042 /nfs/dbraw/zinc/52/40/42/1036524042.db2.gz ASYYTELYIIUYKA-BLVKFPJESA-N 1 1 337.379 4.068 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](c2ccc3cccnc3n2)C1 ZINC000602886116 1036660042 /nfs/dbraw/zinc/66/00/42/1036660042.db2.gz HBOVWDSAJKYDTE-GDBMZVCRSA-N 1 1 348.406 4.089 20 5 EIBDMO COc1ccc([C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C(C)C)c(F)c1 ZINC000421846629 1036823570 /nfs/dbraw/zinc/82/35/70/1036823570.db2.gz TYTFHOWBIATWEB-SFHVURJKSA-N 1 1 332.375 4.229 20 5 EIBDMO CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccc(Cl)s1 ZINC000603837222 1037031582 /nfs/dbraw/zinc/03/15/82/1037031582.db2.gz LFEZZBZRSOSASV-UHFFFAOYSA-N 1 1 340.832 4.211 20 5 EIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H]1c1ccccc1Cl ZINC000603857566 1037051494 /nfs/dbraw/zinc/05/14/94/1037051494.db2.gz XXRZVHZNLGEPBF-INIZCTEOSA-N 1 1 346.814 4.464 20 5 EIBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCCCC[C@@H]2c2ccncc2)cc1 ZINC000603879280 1037070482 /nfs/dbraw/zinc/07/04/82/1037070482.db2.gz ONBWAJKWYWTMHN-LJQANCHMSA-N 1 1 325.412 4.150 20 5 EIBDMO C[NH+](C)[C@@H](CNc1ccc([N+](=O)[O-])s1)c1ccccc1Cl ZINC000603937404 1037100891 /nfs/dbraw/zinc/10/08/91/1037100891.db2.gz RHACAQTXYRIKJJ-LBPRGKRZSA-N 1 1 325.821 4.025 20 5 EIBDMO C[C@H]1C[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)Cc2ccccc21 ZINC000760807640 1037286085 /nfs/dbraw/zinc/28/60/85/1037286085.db2.gz GVXYNIYHAPQNRY-AWEZNQCLSA-N 1 1 349.390 4.369 20 5 EIBDMO C[C@H]1C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)Cc2ccccc21 ZINC000760807640 1037286102 /nfs/dbraw/zinc/28/61/02/1037286102.db2.gz GVXYNIYHAPQNRY-AWEZNQCLSA-N 1 1 349.390 4.369 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccc(OC(F)F)cc1 ZINC000061780549 1037542635 /nfs/dbraw/zinc/54/26/35/1037542635.db2.gz GJNJHHREUJLULI-GFCCVEGCSA-N 1 1 336.338 4.389 20 5 EIBDMO Cc1ccccc1C1([NH2+]Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000592140086 1037748420 /nfs/dbraw/zinc/74/84/20/1037748420.db2.gz YPTKBFIWVPLYJI-UHFFFAOYSA-N 1 1 349.390 4.337 20 5 EIBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])Cn1ccc(=S)c2ccccc21 ZINC000171943066 1037780800 /nfs/dbraw/zinc/78/08/00/1037780800.db2.gz GJMNIZPENHQWJT-UHFFFAOYSA-N 1 1 339.420 4.368 20 5 EIBDMO CC(C)c1ccc([C@@H](N)C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000423235119 1038054608 /nfs/dbraw/zinc/05/46/08/1038054608.db2.gz GHUVHXIREOMJKX-LIRRHRJNSA-N 1 1 327.428 4.069 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000490056589 1038325143 /nfs/dbraw/zinc/32/51/43/1038325143.db2.gz PXYXSTSUQVJDED-DOTOQJQBSA-N 1 1 325.412 4.232 20 5 EIBDMO COc1cccc([C@H]2C[C@@H](C)C[N@@H+]2Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC001168424150 1038622670 /nfs/dbraw/zinc/62/26/70/1038622670.db2.gz UOUTWLLLPJGBOV-BFUOFWGJSA-N 1 1 344.386 4.326 20 5 EIBDMO COc1cccc([C@H]2C[C@@H](C)C[N@H+]2Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC001168424150 1038622679 /nfs/dbraw/zinc/62/26/79/1038622679.db2.gz UOUTWLLLPJGBOV-BFUOFWGJSA-N 1 1 344.386 4.326 20 5 EIBDMO Cc1cc(N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c(F)cc1[N+](=O)[O-] ZINC000461935718 1038838947 /nfs/dbraw/zinc/83/89/47/1038838947.db2.gz KQBJPGONPVGCEV-UONOGXRCSA-N 1 1 335.423 4.107 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@H](c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000608977639 1038986546 /nfs/dbraw/zinc/98/65/46/1038986546.db2.gz XBCONIPBDXNNOF-SFHVURJKSA-N 1 1 340.423 4.373 20 5 EIBDMO COc1ccc(C[N@H+](C)Cc2ccc(F)c(Cl)c2)cc1[N+](=O)[O-] ZINC000514103634 1039610667 /nfs/dbraw/zinc/61/06/67/1039610667.db2.gz CZJQPBNRYXFTRM-UHFFFAOYSA-N 1 1 338.766 4.028 20 5 EIBDMO COc1ccc(C[N@@H+](C)Cc2ccc(F)c(Cl)c2)cc1[N+](=O)[O-] ZINC000514103634 1039610680 /nfs/dbraw/zinc/61/06/80/1039610680.db2.gz CZJQPBNRYXFTRM-UHFFFAOYSA-N 1 1 338.766 4.028 20 5 EIBDMO C[C@]12CC[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C[C@H]1C2(F)F ZINC000430095396 1039840181 /nfs/dbraw/zinc/84/01/81/1039840181.db2.gz CWZBHQUDHRQLEV-SJORKVTESA-N 1 1 348.349 4.332 20 5 EIBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000434986535 1039984884 /nfs/dbraw/zinc/98/48/84/1039984884.db2.gz OYWYOUFSBONCED-GOSISDBHSA-N 1 1 326.396 4.249 20 5 EIBDMO C[C@H]1c2ccccc2CC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000535556607 1040365894 /nfs/dbraw/zinc/36/58/94/1040365894.db2.gz HPRTUFSWSBRVIP-AWEZNQCLSA-N 1 1 349.390 4.369 20 5 EIBDMO C[C@H]1c2ccccc2CC[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000535556607 1040365906 /nfs/dbraw/zinc/36/59/06/1040365906.db2.gz HPRTUFSWSBRVIP-AWEZNQCLSA-N 1 1 349.390 4.369 20 5 EIBDMO Cc1cccc([C@H]2CCC[N@@H+]2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000482695029 1040433140 /nfs/dbraw/zinc/43/31/40/1040433140.db2.gz MXURUNDOTNXAKN-GOSISDBHSA-N 1 1 336.395 4.117 20 5 EIBDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000482695029 1040433147 /nfs/dbraw/zinc/43/31/47/1040433147.db2.gz MXURUNDOTNXAKN-GOSISDBHSA-N 1 1 336.395 4.117 20 5 EIBDMO COc1ccc2c(c1)CCC[C@H]2[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000479556616 1040467184 /nfs/dbraw/zinc/46/71/84/1040467184.db2.gz LTLDRUNILLIJBP-LJQANCHMSA-N 1 1 326.396 4.113 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@@H](c4ccccc4)C3)co2)cc1 ZINC000089891087 1040516784 /nfs/dbraw/zinc/51/67/84/1040516784.db2.gz GVHDBCYFYJHNIS-QGZVFWFLSA-N 1 1 349.390 4.239 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC000462446917 1040613220 /nfs/dbraw/zinc/61/32/20/1040613220.db2.gz LZNLTRXTBZFQRC-LSDHHAIUSA-N 1 1 345.468 4.096 20 5 EIBDMO CC(C)CO[C@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000537724803 1040776537 /nfs/dbraw/zinc/77/65/37/1040776537.db2.gz FVXAPZVTJBUTAI-KRWDZBQOSA-N 1 1 344.411 4.102 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCO[C@@H](c2ccccc2C)C1 ZINC000539808792 1040804321 /nfs/dbraw/zinc/80/43/21/1040804321.db2.gz XCHKOMKNEBVROL-OXQOHEQNSA-N 1 1 340.423 4.346 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCO[C@@H](c2ccccc2C)C1 ZINC000539808792 1040804322 /nfs/dbraw/zinc/80/43/22/1040804322.db2.gz XCHKOMKNEBVROL-OXQOHEQNSA-N 1 1 340.423 4.346 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+](CC3CC3)C3CCC3)o2)c1 ZINC000483306796 1040813138 /nfs/dbraw/zinc/81/31/38/1040813138.db2.gz KUUWFWMXEJOHQR-UHFFFAOYSA-N 1 1 341.411 4.057 20 5 EIBDMO COc1cccc(C[C@@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000515553204 1040850666 /nfs/dbraw/zinc/85/06/66/1040850666.db2.gz XAHFNLZOWQCVSM-SFHVURJKSA-N 1 1 340.423 4.119 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(-c3ccccc3)o2)c(F)c1 ZINC000480048557 1040890536 /nfs/dbraw/zinc/89/05/36/1040890536.db2.gz CKDWRNDGZPYCAO-UHFFFAOYSA-N 1 1 326.327 4.284 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1COc2ccc(Cl)cc21 ZINC000540161672 1041194437 /nfs/dbraw/zinc/19/44/37/1041194437.db2.gz YXAJDNMIFVKSQP-MEDUHNTESA-N 1 1 332.787 4.341 20 5 EIBDMO Cc1c(C[N@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000484346772 1041220267 /nfs/dbraw/zinc/22/02/67/1041220267.db2.gz ZMHYPPVQELDQKH-AWEZNQCLSA-N 1 1 330.350 4.314 20 5 EIBDMO Cc1ccnc(Nc2ccc3c(c2)[nH+]c2n3CCCCC2)c1[N+](=O)[O-] ZINC000554653816 1041303230 /nfs/dbraw/zinc/30/32/30/1041303230.db2.gz HNDJEGGOGCCDLS-UHFFFAOYSA-N 1 1 337.383 4.118 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1c1ccc(C)cc1 ZINC000484548011 1041321046 /nfs/dbraw/zinc/32/10/46/1041321046.db2.gz ZUZWFHQMVSXQRH-GOSISDBHSA-N 1 1 326.396 4.249 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](COc2ccccc2)C1 ZINC000505880239 1041475779 /nfs/dbraw/zinc/47/57/79/1041475779.db2.gz RLNRIGYVHQZZCO-HZPDHXFCSA-N 1 1 326.396 4.057 20 5 EIBDMO CC[N@@H+](CCc1nccs1)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000470178738 1041569168 /nfs/dbraw/zinc/56/91/68/1041569168.db2.gz NCEQLGGPQGPCFE-SDNWHVSQSA-N 1 1 331.441 4.019 20 5 EIBDMO C[N@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463443016 1041569494 /nfs/dbraw/zinc/56/94/94/1041569494.db2.gz MNONEVAKRHKYDU-RISCZKNCSA-N 1 1 334.313 4.287 20 5 EIBDMO C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463443016 1041569499 /nfs/dbraw/zinc/56/94/99/1041569499.db2.gz MNONEVAKRHKYDU-RISCZKNCSA-N 1 1 334.313 4.287 20 5 EIBDMO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1F ZINC000463469176 1041587709 /nfs/dbraw/zinc/58/77/09/1041587709.db2.gz JBUFBMMPERVADV-MRXNPFEDSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1cc(C[N@H+]2CCC[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1F ZINC000463469176 1041587712 /nfs/dbraw/zinc/58/77/12/1041587712.db2.gz JBUFBMMPERVADV-MRXNPFEDSA-N 1 1 330.359 4.080 20 5 EIBDMO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1cc(F)c(F)c(F)c1 ZINC000540768200 1041656565 /nfs/dbraw/zinc/65/65/65/1041656565.db2.gz GZZYONASFSJILA-GQCTYLIASA-N 1 1 336.313 4.157 20 5 EIBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1cc(F)c(F)c(F)c1 ZINC000540768200 1041656577 /nfs/dbraw/zinc/65/65/77/1041656577.db2.gz GZZYONASFSJILA-GQCTYLIASA-N 1 1 336.313 4.157 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(C(F)(F)F)CC1 ZINC000464777305 1042159991 /nfs/dbraw/zinc/15/99/91/1042159991.db2.gz VJCQIDMBTNPSBX-UHFFFAOYSA-N 1 1 346.349 4.156 20 5 EIBDMO CCC1(CC)CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000438500344 1042213610 /nfs/dbraw/zinc/21/36/10/1042213610.db2.gz IBNGNJKTRQPFSC-UHFFFAOYSA-N 1 1 343.427 4.304 20 5 EIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](CC)[C@@H](C)c1cccc(O)c1 ZINC000509581075 1042388602 /nfs/dbraw/zinc/38/86/02/1042388602.db2.gz XLGJGLPXDPRJLO-AWEZNQCLSA-N 1 1 344.411 4.282 20 5 EIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](CC)[C@@H](C)c1cccc(O)c1 ZINC000509581075 1042388606 /nfs/dbraw/zinc/38/86/06/1042388606.db2.gz XLGJGLPXDPRJLO-AWEZNQCLSA-N 1 1 344.411 4.282 20 5 EIBDMO CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H](C)Cc1ccc(OC)cc1 ZINC000506418509 1042394795 /nfs/dbraw/zinc/39/47/95/1042394795.db2.gz YXUDKGMZQWTAJV-HNNXBMFYSA-N 1 1 328.412 4.057 20 5 EIBDMO COc1ccccc1[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000108421320 1042409980 /nfs/dbraw/zinc/40/99/80/1042409980.db2.gz IIUZSWKADPWHDV-OAQYLSRUSA-N 1 1 348.402 4.483 20 5 EIBDMO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000518459459 1042531563 /nfs/dbraw/zinc/53/15/63/1042531563.db2.gz LNKDXGVPPXWGAW-ZDUSSCGKSA-N 1 1 334.803 4.320 20 5 EIBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@H](C)c1cccc(OC)c1 ZINC000518472768 1042539203 /nfs/dbraw/zinc/53/92/03/1042539203.db2.gz NNRLZZOLCGZNQM-CQSZACIVSA-N 1 1 344.411 4.195 20 5 EIBDMO CCOc1cc(C[N@@H+](CC)CCc2cccs2)ccc1[N+](=O)[O-] ZINC000492358772 1042622011 /nfs/dbraw/zinc/62/20/11/1042622011.db2.gz TZPCDQILZWTERL-UHFFFAOYSA-N 1 1 334.441 4.120 20 5 EIBDMO Cc1nc2ccc(C[N@@H+]3CCc4ccc([N+](=O)[O-])cc4C3)cc2s1 ZINC000426415008 1042684836 /nfs/dbraw/zinc/68/48/36/1042684836.db2.gz CJEUTIMLHZGFAE-UHFFFAOYSA-N 1 1 339.420 4.071 20 5 EIBDMO Cc1nc2ccc(C[N@H+]3CCc4ccc([N+](=O)[O-])cc4C3)cc2s1 ZINC000426415008 1042684838 /nfs/dbraw/zinc/68/48/38/1042684838.db2.gz CJEUTIMLHZGFAE-UHFFFAOYSA-N 1 1 339.420 4.071 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)cc1Cl ZINC000761506891 1042872582 /nfs/dbraw/zinc/87/25/82/1042872582.db2.gz OWAMJHFNOMCAJD-INIZCTEOSA-N 1 1 332.787 4.291 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)cc1Cl ZINC000761506891 1042872584 /nfs/dbraw/zinc/87/25/84/1042872584.db2.gz OWAMJHFNOMCAJD-INIZCTEOSA-N 1 1 332.787 4.291 20 5 EIBDMO COc1ccc([C@H]2CC[N@H+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)cc1 ZINC000441535015 1042878417 /nfs/dbraw/zinc/87/84/17/1042878417.db2.gz OKBOXZCWPPBQGD-ZBFHGGJFSA-N 1 1 326.396 4.154 20 5 EIBDMO CC1(C)C[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])c2ccc(F)cc2O1 ZINC000133286602 1043250221 /nfs/dbraw/zinc/25/02/21/1043250221.db2.gz HCIFOUUUUPSPML-OAHLLOKOSA-N 1 1 330.359 4.126 20 5 EIBDMO COc1ccc(C2([NH2+]Cc3cc([N+](=O)[O-])ccc3Cl)CC2)cc1 ZINC000731679016 1043816503 /nfs/dbraw/zinc/81/65/03/1043816503.db2.gz SNFUOAKNSYKCBA-UHFFFAOYSA-N 1 1 332.787 4.036 20 5 EIBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@@H](C)C1 ZINC000443065982 1043984506 /nfs/dbraw/zinc/98/45/06/1043984506.db2.gz BRIURUOONOGOSR-KBPBESRZSA-N 1 1 346.452 4.323 20 5 EIBDMO CC(C)[C@H](c1ccccc1)[N@@H+](C)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000732979014 1044056900 /nfs/dbraw/zinc/05/69/00/1044056900.db2.gz BNDWFXQXTJRTQY-LJQANCHMSA-N 1 1 338.411 4.231 20 5 EIBDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000766208895 1044486521 /nfs/dbraw/zinc/48/65/21/1044486521.db2.gz AKEKJQBAMFJRHJ-GFCCVEGCSA-N 1 1 334.803 4.017 20 5 EIBDMO CC1(C)Cc2cccc(C[NH2+]Cc3ccc([N+](=O)[O-])cc3Cl)c2O1 ZINC000466464557 1044546221 /nfs/dbraw/zinc/54/62/21/1044546221.db2.gz LIZCJXDMLPULTD-UHFFFAOYSA-N 1 1 346.814 4.252 20 5 EIBDMO CC(C)c1ccc(C[NH2+][C@H]2COc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000466472153 1044575551 /nfs/dbraw/zinc/57/55/51/1044575551.db2.gz GEMRHHOFUNXDSS-INIZCTEOSA-N 1 1 330.359 4.081 20 5 EIBDMO CC(C)[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC1CCC1 ZINC000193210201 1044766645 /nfs/dbraw/zinc/76/66/45/1044766645.db2.gz JSAJQJYPIVIYFI-UHFFFAOYSA-N 1 1 343.427 4.303 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc(CSC(F)F)o1)c1ccc([N+](=O)[O-])cc1 ZINC000922542870 1044810384 /nfs/dbraw/zinc/81/03/84/1044810384.db2.gz FGGOOLOVXCZNNF-SNVBAGLBSA-N 1 1 342.367 4.494 20 5 EIBDMO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1ccc([N+](=O)[O-])cc1 ZINC000154642369 1044821625 /nfs/dbraw/zinc/82/16/25/1044821625.db2.gz AAFSEUMQDQGXGA-YWZLYKJASA-N 1 1 333.391 4.430 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCCO[C@H](c3ccccc3)C2)c1 ZINC000735491500 1044832996 /nfs/dbraw/zinc/83/29/96/1044832996.db2.gz IPDZZIVJSLYGDE-SFHVURJKSA-N 1 1 346.814 4.212 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCCO[C@H](c3ccccc3)C2)c1 ZINC000735491500 1044832997 /nfs/dbraw/zinc/83/29/97/1044832997.db2.gz IPDZZIVJSLYGDE-SFHVURJKSA-N 1 1 346.814 4.212 20 5 EIBDMO CC1(C)C[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCS1 ZINC000093504279 1044839724 /nfs/dbraw/zinc/83/97/24/1044839724.db2.gz ZKWMXMGSAZXZGN-UHFFFAOYSA-N 1 1 349.481 4.046 20 5 EIBDMO CC1(C)C[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCS1 ZINC000093504279 1044839733 /nfs/dbraw/zinc/83/97/33/1044839733.db2.gz ZKWMXMGSAZXZGN-UHFFFAOYSA-N 1 1 349.481 4.046 20 5 EIBDMO CN(C)c1cccc([C@H]2CCC[N@H+]2Cc2cc(F)ccc2[N+](=O)[O-])c1 ZINC000735875160 1044871449 /nfs/dbraw/zinc/87/14/49/1044871449.db2.gz ZTUWBWSHVDMMOZ-GOSISDBHSA-N 1 1 343.402 4.137 20 5 EIBDMO CCc1cccc(Cl)c1C[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000474350685 1044878044 /nfs/dbraw/zinc/87/80/44/1044878044.db2.gz QFSBMAHNJCIYCN-UHFFFAOYSA-N 1 1 334.803 4.109 20 5 EIBDMO CCc1onc(C)c1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000922987716 1044889477 /nfs/dbraw/zinc/88/94/77/1044889477.db2.gz ITBKSEODWBBCMZ-UHFFFAOYSA-N 1 1 341.367 4.003 20 5 EIBDMO CC[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)Cc1ccccn1 ZINC000124807555 1044894257 /nfs/dbraw/zinc/89/42/57/1044894257.db2.gz SLKFKAGGTMCYAW-UHFFFAOYSA-N 1 1 337.379 4.272 20 5 EIBDMO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC(c2ccccc2F)CC1 ZINC000736311388 1044923943 /nfs/dbraw/zinc/92/39/43/1044923943.db2.gz IZFGUYMYJZBDRV-UHFFFAOYSA-N 1 1 332.350 4.253 20 5 EIBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)Cc1ccccn1 ZINC000543619933 1044961315 /nfs/dbraw/zinc/96/13/15/1044961315.db2.gz OKHRDTHQOARLKI-UHFFFAOYSA-N 1 1 339.420 4.350 20 5 EIBDMO Cc1cc(C)cc([C@@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000611392848 1045298768 /nfs/dbraw/zinc/29/87/68/1045298768.db2.gz PPNPGJXJALWKEZ-CYBMUJFWSA-N 1 1 325.368 4.204 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[NH2+][C@H](CC3CC3)c3ccccc3)nc2c1 ZINC000611395621 1045300273 /nfs/dbraw/zinc/30/02/73/1045300273.db2.gz KUXDJYBWJBDHSN-MRXNPFEDSA-N 1 1 337.379 4.367 20 5 EIBDMO CC[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000767823502 1045647353 /nfs/dbraw/zinc/64/73/53/1045647353.db2.gz MAVKSHLBQADCCJ-KRWDZBQOSA-N 1 1 348.830 4.021 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1cncc2ccccc21)C1CC1 ZINC000768333551 1045791113 /nfs/dbraw/zinc/79/11/13/1045791113.db2.gz DUUBKDHDQVSQPH-UHFFFAOYSA-N 1 1 333.391 4.308 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cncc2ccccc21)C1CC1 ZINC000768333551 1045791132 /nfs/dbraw/zinc/79/11/32/1045791132.db2.gz DUUBKDHDQVSQPH-UHFFFAOYSA-N 1 1 333.391 4.308 20 5 EIBDMO COc1ccc(C[C@@H](C)[N@@H+](C)Cc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC001170341222 1046019470 /nfs/dbraw/zinc/01/94/70/1046019470.db2.gz HEHVZFKIWSHYAY-CYBMUJFWSA-N 1 1 348.830 4.320 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCc3ccccc3CC2)ccc1Cl ZINC001170342228 1046019780 /nfs/dbraw/zinc/01/97/80/1046019780.db2.gz JNLVQNFXORQLHM-UHFFFAOYSA-N 1 1 330.815 4.239 20 5 EIBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2ccccc2Cl)cc1[N+](=O)[O-] ZINC000152515031 1046096037 /nfs/dbraw/zinc/09/60/37/1046096037.db2.gz FOLLSOVZBWOEKW-GFCCVEGCSA-N 1 1 334.803 4.498 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@]2(C)[C@@H](C1)C2(Cl)Cl ZINC000792911382 1046104563 /nfs/dbraw/zinc/10/45/63/1046104563.db2.gz XBOWPQKWGOMALE-HONMWMINSA-N 1 1 329.227 4.172 20 5 EIBDMO c1ccc2c(c1)cc1ccccc1c2C[N@H+]1CCO[C@H]([C@H]2CCCO2)C1 ZINC000770303689 1046176726 /nfs/dbraw/zinc/17/67/26/1046176726.db2.gz IPGGPHZVTKCETO-PKTZIBPZSA-N 1 1 347.458 4.373 20 5 EIBDMO c1ccc2c(c1)cc1ccccc1c2C[N@H+]1CCO[C@H]([C@@H]2CCCO2)C1 ZINC000770303684 1046176702 /nfs/dbraw/zinc/17/67/02/1046176702.db2.gz IPGGPHZVTKCETO-GOTSBHOMSA-N 1 1 347.458 4.373 20 5 EIBDMO CC[N@@H+](Cc1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1)C(C)C ZINC000508778562 1046568735 /nfs/dbraw/zinc/56/87/35/1046568735.db2.gz MWBRRKONMXXALU-UHFFFAOYSA-N 1 1 341.411 4.077 20 5 EIBDMO Cc1ccc(CNc2cc(Cl)ccc2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000804605537 1046651151 /nfs/dbraw/zinc/65/11/51/1046651151.db2.gz UFYDDVHTXSZVKV-UHFFFAOYSA-N 1 1 346.818 4.164 20 5 EIBDMO COc1cc(C[N@H+]2CCC[C@H](c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC001170481927 1046900168 /nfs/dbraw/zinc/90/01/68/1046900168.db2.gz YHPZIEWSKUTCKJ-HNNXBMFYSA-N 1 1 344.386 4.122 20 5 EIBDMO COc1ccc(C[N@@H+](C)C/C(C)=C/c2cccc([N+](=O)[O-])c2)cc1F ZINC000787405868 1047005471 /nfs/dbraw/zinc/00/54/71/1047005471.db2.gz FVJKTSKHSCXBPA-NTEUORMPSA-N 1 1 344.386 4.278 20 5 EIBDMO C[C@@H]1C[C@@H](c2ccccc2)[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC001170084546 1047185057 /nfs/dbraw/zinc/18/50/57/1047185057.db2.gz BWZIUQKAQXUIBP-BEFAXECRSA-N 1 1 326.396 4.057 20 5 EIBDMO CCOc1ccc([C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000788471896 1047195341 /nfs/dbraw/zinc/19/53/41/1047195341.db2.gz WOLGAPLIYNOOOD-GOSISDBHSA-N 1 1 344.386 4.470 20 5 EIBDMO CCOc1ccc([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000788471896 1047195349 /nfs/dbraw/zinc/19/53/49/1047195349.db2.gz WOLGAPLIYNOOOD-GOSISDBHSA-N 1 1 344.386 4.470 20 5 EIBDMO CC[N@H+](Cc1ccc(Cl)s1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788468790 1047195912 /nfs/dbraw/zinc/19/59/12/1047195912.db2.gz BDJOEAVCMQUDGA-UHFFFAOYSA-N 1 1 328.796 4.471 20 5 EIBDMO CC[N@@H+](Cc1ccc(Cl)s1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788468790 1047195915 /nfs/dbraw/zinc/19/59/15/1047195915.db2.gz BDJOEAVCMQUDGA-UHFFFAOYSA-N 1 1 328.796 4.471 20 5 EIBDMO C[C@H]1C[C@@H](c2ccccc2)[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC001170086830 1047243974 /nfs/dbraw/zinc/24/39/74/1047243974.db2.gz YGVYBKCNKCESCQ-YJBOKZPZSA-N 1 1 326.396 4.057 20 5 EIBDMO Cc1cc([NH+]2CCCC2)ccc1N[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788692831 1047265169 /nfs/dbraw/zinc/26/51/69/1047265169.db2.gz RGSIEMATZYDQHK-AWEZNQCLSA-N 1 1 340.427 4.259 20 5 EIBDMO COc1cccc(C2=CC[N@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000476268814 1047440944 /nfs/dbraw/zinc/44/09/44/1047440944.db2.gz MLBGVWOAOZIMBW-HNNXBMFYSA-N 1 1 338.407 4.454 20 5 EIBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000609287793 1047692633 /nfs/dbraw/zinc/69/26/33/1047692633.db2.gz TZORYKWSTOCCGY-GFCCVEGCSA-N 1 1 343.349 4.042 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1Cc2ccccc2O[C@H](C)C1 ZINC001170733081 1047880580 /nfs/dbraw/zinc/88/05/80/1047880580.db2.gz PXJBBMIFBMHNIX-CABCVRRESA-N 1 1 326.396 4.247 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1Cc2ccccc2O[C@H](C)C1 ZINC001170733081 1047880583 /nfs/dbraw/zinc/88/05/83/1047880583.db2.gz PXJBBMIFBMHNIX-CABCVRRESA-N 1 1 326.396 4.247 20 5 EIBDMO CC(C)c1ccc(C[NH2+]Cc2cc(F)cnc2Cl)cc1[N+](=O)[O-] ZINC000824538916 1047887866 /nfs/dbraw/zinc/88/78/66/1047887866.db2.gz VBRAJYUHKHWWGA-UHFFFAOYSA-N 1 1 337.782 4.196 20 5 EIBDMO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000808761314 1048087376 /nfs/dbraw/zinc/08/73/76/1048087376.db2.gz LQAKPTNLPTZTJH-KRWDZBQOSA-N 1 1 332.375 4.326 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844436972 1048334651 /nfs/dbraw/zinc/33/46/51/1048334651.db2.gz JVPSVNOLHLNGJY-INIZCTEOSA-N 1 1 340.370 4.003 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3ccncc3)CC2)cc1Cl ZINC000809730446 1048479979 /nfs/dbraw/zinc/47/99/79/1048479979.db2.gz OBMDPQUYUVFNLV-UHFFFAOYSA-N 1 1 331.803 4.023 20 5 EIBDMO CCC[N@@H+](CCc1ccccn1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809734752 1048483603 /nfs/dbraw/zinc/48/36/03/1048483603.db2.gz PYDIGZRSQSXYRS-UHFFFAOYSA-N 1 1 333.819 4.098 20 5 EIBDMO C[C@]1(CCCO)CCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809969730 1048576192 /nfs/dbraw/zinc/57/61/92/1048576192.db2.gz ZJUHGHZHRICYIG-OAHLLOKOSA-N 1 1 347.242 4.029 20 5 EIBDMO C[C@]1(CCCO)CCC[N@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809969730 1048576206 /nfs/dbraw/zinc/57/62/06/1048576206.db2.gz ZJUHGHZHRICYIG-OAHLLOKOSA-N 1 1 347.242 4.029 20 5 EIBDMO CO[C@@H](C)C[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C(C)C ZINC000809949023 1048580244 /nfs/dbraw/zinc/58/02/44/1048580244.db2.gz WAHPYFMQSJYRSZ-JTQLQIEISA-N 1 1 335.231 4.147 20 5 EIBDMO CCCC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[C@@H](C)C1 ZINC001170683707 1049541671 /nfs/dbraw/zinc/54/16/71/1049541671.db2.gz SZZXNQUQSCGXAB-LZQZEXGQSA-N 1 1 334.460 4.309 20 5 EIBDMO CC[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812851313 1049614014 /nfs/dbraw/zinc/61/40/14/1049614014.db2.gz YCJOVMXPRVUHDU-FZKQIMNGSA-N 1 1 348.830 4.192 20 5 EIBDMO C[C@H](CSc1ccccc1)[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC001171772411 1049794139 /nfs/dbraw/zinc/79/41/39/1049794139.db2.gz MZXDBCNGXNYUTP-CYBMUJFWSA-N 1 1 334.416 4.347 20 5 EIBDMO C[N@@H+](CCc1cccc(F)c1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172913894 1050231135 /nfs/dbraw/zinc/23/11/35/1050231135.db2.gz VNHXRFBUSVYVJI-IBGZPJMESA-N 1 1 342.414 4.156 20 5 EIBDMO C[N@@H+](CCc1cccs1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172915138 1050231307 /nfs/dbraw/zinc/23/13/07/1050231307.db2.gz LQCSSDHGTRJDDZ-MRXNPFEDSA-N 1 1 330.453 4.078 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCC[C@H]1c1nccs1)CC2 ZINC001172920987 1050234308 /nfs/dbraw/zinc/23/43/08/1050234308.db2.gz NFEHZQREECSRBT-RDJZCZTQSA-N 1 1 343.452 4.136 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCC[C@@H](C(F)(F)F)C1)CC2 ZINC001172910874 1050245474 /nfs/dbraw/zinc/24/54/74/1050245474.db2.gz PRKKOEIEGDOPBD-CABCVRRESA-N 1 1 342.361 4.117 20 5 EIBDMO CCC[N@@H+]([C@@H](C)CC)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173184199 1050336692 /nfs/dbraw/zinc/33/66/92/1050336692.db2.gz LWMPVTJAJRFYLD-STQMWFEESA-N 1 1 326.412 4.184 20 5 EIBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)[C@H]2CC[C@H](C)CC2)c1F ZINC001173194654 1050340221 /nfs/dbraw/zinc/34/02/21/1050340221.db2.gz XRZKCYMRUUKYMU-MGPQQGTHSA-N 1 1 338.423 4.184 20 5 EIBDMO C[N@@H+](Cc1ccccc1)C1(CNc2sccc2[N+](=O)[O-])CCC1 ZINC001186516628 1050348874 /nfs/dbraw/zinc/34/88/74/1050348874.db2.gz AKPZNZQDNZZRAV-UHFFFAOYSA-N 1 1 331.441 4.123 20 5 EIBDMO CC(C)(C)[N@H+]1CC[C@@H](CNc2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC001187014309 1050459122 /nfs/dbraw/zinc/45/91/22/1050459122.db2.gz PDLQCHUOVDXZIS-NSHDSACASA-N 1 1 345.365 4.146 20 5 EIBDMO CC[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1OC ZINC000775081545 1050472342 /nfs/dbraw/zinc/47/23/42/1050472342.db2.gz VSMYNEVQJAKKOI-OAHLLOKOSA-N 1 1 334.803 4.498 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc3cnccc3c2)C2CC2)cc1 ZINC000618809082 1050536541 /nfs/dbraw/zinc/53/65/41/1050536541.db2.gz ZGZBPOJANYEYFM-UHFFFAOYSA-N 1 1 333.391 4.308 20 5 EIBDMO CC(C)c1cc(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)on1 ZINC000618984248 1050611655 /nfs/dbraw/zinc/61/16/55/1050611655.db2.gz FCKMUUVGVULUAE-KRWDZBQOSA-N 1 1 329.400 4.218 20 5 EIBDMO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000775142156 1050613544 /nfs/dbraw/zinc/61/35/44/1050613544.db2.gz DDLDKTATDILYQG-SNVBAGLBSA-N 1 1 338.766 4.247 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](Cc3ccc(F)cc3)C2)cc1Cl ZINC001179952074 1050830134 /nfs/dbraw/zinc/83/01/34/1050830134.db2.gz OEIMLDINXYJVJU-OAHLLOKOSA-N 1 1 348.805 4.452 20 5 EIBDMO CC1CCC([N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000170906125 1050852014 /nfs/dbraw/zinc/85/20/14/1050852014.db2.gz ABIAZJGZYBSXQO-UHFFFAOYSA-N 1 1 343.427 4.303 20 5 EIBDMO CCO[C@@H]1C[C@H]([N@@H+](C)C/C(C)=C\c2cccc([N+](=O)[O-])c2)C12CCC2 ZINC001180132856 1050881673 /nfs/dbraw/zinc/88/16/73/1050881673.db2.gz NROXLBCEIQWAHL-GYVFVFFDSA-N 1 1 344.455 4.278 20 5 EIBDMO Cc1nn(C(C)C)c(C)c1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC001180177783 1050895503 /nfs/dbraw/zinc/89/55/03/1050895503.db2.gz FYZGMZDDUZJCCU-UHFFFAOYSA-N 1 1 344.459 4.400 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000619784535 1050901862 /nfs/dbraw/zinc/90/18/62/1050901862.db2.gz YJCHGQNRYSCIET-AWEZNQCLSA-N 1 1 346.324 4.288 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000619784535 1050901872 /nfs/dbraw/zinc/90/18/72/1050901872.db2.gz YJCHGQNRYSCIET-AWEZNQCLSA-N 1 1 346.324 4.288 20 5 EIBDMO CC(C)c1ccc(C[N@@H+](C)C[C@@H](C)c2nccs2)cc1[N+](=O)[O-] ZINC000183255729 1051038072 /nfs/dbraw/zinc/03/80/72/1051038072.db2.gz VAJPCOOJGDZDMA-CYBMUJFWSA-N 1 1 333.457 4.410 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC(c3ccc(F)cn3)CC2)c1 ZINC001174715705 1051146789 /nfs/dbraw/zinc/14/67/89/1051146789.db2.gz MGRVRTKHBZEJPQ-UHFFFAOYSA-N 1 1 349.793 4.162 20 5 EIBDMO C[C@@H](c1ccccc1Cl)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC001190418255 1051179057 /nfs/dbraw/zinc/17/90/57/1051179057.db2.gz YBDHJRUNZLGLGC-ZDUSSCGKSA-N 1 1 334.803 4.320 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@H]3CC3CCCCC3)nc2c1 ZINC001190642590 1051241049 /nfs/dbraw/zinc/24/10/49/1051241049.db2.gz DWQNQWWMODDVLK-HNNXBMFYSA-N 1 1 342.443 4.406 20 5 EIBDMO CC[C@@H](Cc1ccc(C)cc1)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC001191269802 1051413382 /nfs/dbraw/zinc/41/33/82/1051413382.db2.gz WUXOVEMABPSGJI-SFHVURJKSA-N 1 1 342.439 4.235 20 5 EIBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CC2(CCC2)[C@@H]1C1CC1 ZINC001182184368 1051414930 /nfs/dbraw/zinc/41/49/30/1051414930.db2.gz OBDUYFNTRYNXBG-HNNXBMFYSA-N 1 1 340.345 4.378 20 5 EIBDMO CC(C)=CCC[C@@H](C)CC[NH+]1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC001182226353 1051436086 /nfs/dbraw/zinc/43/60/86/1051436086.db2.gz IZLCPTHZITXUBV-MRXNPFEDSA-N 1 1 332.444 4.430 20 5 EIBDMO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC(Cc2ccccc2F)CC1 ZINC001191520464 1051471474 /nfs/dbraw/zinc/47/14/74/1051471474.db2.gz HOCRFCKJKHMVNZ-UHFFFAOYSA-N 1 1 346.377 4.328 20 5 EIBDMO CC[C@H](Cc1ccccc1)[N@@H+](CC)CCOc1cccc([N+](=O)[O-])c1 ZINC001192107414 1051631764 /nfs/dbraw/zinc/63/17/64/1051631764.db2.gz HOSLLNKQNPMITD-GOSISDBHSA-N 1 1 342.439 4.317 20 5 EIBDMO C[C@H]1C[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CC(C)(C)C1 ZINC001192502048 1051747546 /nfs/dbraw/zinc/74/75/46/1051747546.db2.gz RORAIBIYJFYLSP-LLVKDONJSA-N 1 1 341.249 4.225 20 5 EIBDMO C[C@H]1C[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CC(C)(C)C1 ZINC001192502048 1051747552 /nfs/dbraw/zinc/74/75/52/1051747552.db2.gz RORAIBIYJFYLSP-LLVKDONJSA-N 1 1 341.249 4.225 20 5 EIBDMO Cc1ccc2sc(C[NH2+][C@@H](C)c3ccc([N+](=O)[O-])cc3)nc2c1 ZINC001176037459 1051881653 /nfs/dbraw/zinc/88/16/53/1051881653.db2.gz VNJHHXDYBWLFMM-LBPRGKRZSA-N 1 1 327.409 4.364 20 5 EIBDMO CC(C)c1cccc2c1CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])C2 ZINC001194042793 1052059992 /nfs/dbraw/zinc/05/99/92/1052059992.db2.gz ZQJNRLZAIJKLFD-UHFFFAOYSA-N 1 1 340.423 4.155 20 5 EIBDMO C[C@@H](CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1 ZINC001184839439 1052114616 /nfs/dbraw/zinc/11/46/16/1052114616.db2.gz IXXDHQLMLKPSLI-RYUDHWBXSA-N 1 1 345.365 4.146 20 5 EIBDMO CCC[N@H+]1CC[C@@H](CNc2c(Cl)c(Cl)ccc2[N+](=O)[O-])C1 ZINC001185028741 1052155903 /nfs/dbraw/zinc/15/59/03/1052155903.db2.gz KXUUQNIOCVBKBI-JTQLQIEISA-N 1 1 332.231 4.045 20 5 EIBDMO CC(C)[N@H+](Cc1cccc(F)c1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774830942 1052179196 /nfs/dbraw/zinc/17/91/96/1052179196.db2.gz ARMIAGIZTRKKFI-UHFFFAOYSA-N 1 1 347.346 4.053 20 5 EIBDMO CC(C)[N@@H+](Cc1cccc(F)c1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774830942 1052179203 /nfs/dbraw/zinc/17/92/03/1052179203.db2.gz ARMIAGIZTRKKFI-UHFFFAOYSA-N 1 1 347.346 4.053 20 5 EIBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccc2c(c1)CCCO2 ZINC000850444360 1053218808 /nfs/dbraw/zinc/21/88/08/1053218808.db2.gz ITGAYHVXSYAHPJ-LBPRGKRZSA-N 1 1 346.814 4.424 20 5 EIBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@@H]1CCCC[C@H]1c1ccccc1 ZINC001195156822 1053307631 /nfs/dbraw/zinc/30/76/31/1053307631.db2.gz ZORVMXAICLARRW-ZWKOTPCHSA-N 1 1 325.412 4.148 20 5 EIBDMO Cc1c(C[N@H+]2CCC[C@@H]2Cc2cc(F)ccc2F)cccc1[N+](=O)[O-] ZINC001195256805 1053348870 /nfs/dbraw/zinc/34/88/70/1053348870.db2.gz CQFKONKELBFJCU-QGZVFWFLSA-N 1 1 346.377 4.389 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH+]2CCC([C@H]3CCCCO3)CC2)ccc1Cl ZINC000852595756 1053594305 /nfs/dbraw/zinc/59/43/05/1053594305.db2.gz VILVKLOYOVRVNB-QGZVFWFLSA-N 1 1 338.835 4.029 20 5 EIBDMO CCCCC[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001196329489 1053640675 /nfs/dbraw/zinc/64/06/75/1053640675.db2.gz PFKBUYIVFNSFAZ-HNNXBMFYSA-N 1 1 335.404 4.438 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCCC[C@H]2C[C@H](O)c2ccco2)cc1 ZINC000121901189 1053855340 /nfs/dbraw/zinc/85/53/40/1053855340.db2.gz YUBGZGJTXZEFQW-ROUUACIJSA-N 1 1 344.411 4.056 20 5 EIBDMO CC(C)(O)C[N@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000775765772 1053869403 /nfs/dbraw/zinc/86/94/03/1053869403.db2.gz REWXWVKBOPHIDJ-UHFFFAOYSA-N 1 1 348.830 4.021 20 5 EIBDMO CC(C)(O)C[N@@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000775765772 1053869410 /nfs/dbraw/zinc/86/94/10/1053869410.db2.gz REWXWVKBOPHIDJ-UHFFFAOYSA-N 1 1 348.830 4.021 20 5 EIBDMO Cc1ccc(N2CCC(Nc3ccc([N+](=O)[O-])cc3Cl)CC2)[nH+]c1 ZINC000301408891 1053870435 /nfs/dbraw/zinc/87/04/35/1053870435.db2.gz WTHRRUXHDFJYJT-UHFFFAOYSA-N 1 1 346.818 4.033 20 5 EIBDMO C[C@@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H]1c1ccccc1 ZINC001197661419 1053961431 /nfs/dbraw/zinc/96/14/31/1053961431.db2.gz VOCSBYATLUUCDZ-BFUOFWGJSA-N 1 1 336.395 4.054 20 5 EIBDMO C[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H]1c1ccccc1 ZINC001197661419 1053961443 /nfs/dbraw/zinc/96/14/43/1053961443.db2.gz VOCSBYATLUUCDZ-BFUOFWGJSA-N 1 1 336.395 4.054 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@@H]2[C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC001198010203 1054044821 /nfs/dbraw/zinc/04/48/21/1054044821.db2.gz FSYOHCVUIMZTHZ-MAUKXSAKSA-N 1 1 340.423 4.372 20 5 EIBDMO Cc1csc(C[C@H]2CC[N@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC001198084065 1054067430 /nfs/dbraw/zinc/06/74/30/1054067430.db2.gz FRFUFICSFDMOJA-LSDHHAIUSA-N 1 1 345.468 4.294 20 5 EIBDMO C[C@@]1(Cc2cccs2)CCC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC001198299036 1054118032 /nfs/dbraw/zinc/11/80/32/1054118032.db2.gz CQFRERXIYYTBOQ-KRWDZBQOSA-N 1 1 334.416 4.393 20 5 EIBDMO C[C@]1(Cc2cccs2)CCC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC001198300401 1054120107 /nfs/dbraw/zinc/12/01/07/1054120107.db2.gz NBLBMTALGRITMO-QGZVFWFLSA-N 1 1 334.416 4.393 20 5 EIBDMO C[C@H]([NH2+][C@H](c1ccccc1)[C@@H]1CCCO1)c1c(F)cccc1[N+](=O)[O-] ZINC000872026930 1054343048 /nfs/dbraw/zinc/34/30/48/1054343048.db2.gz AAAOHGICLUMYIN-SOVGHPHASA-N 1 1 344.386 4.305 20 5 EIBDMO Cc1cccnc1[C@@H]([NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])C(C)C ZINC000872034135 1054349147 /nfs/dbraw/zinc/34/91/47/1054349147.db2.gz IBBVMSWCNKLNDD-DYVFJYSZSA-N 1 1 331.391 4.485 20 5 EIBDMO C[C@@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000872060561 1054370286 /nfs/dbraw/zinc/37/02/86/1054370286.db2.gz RAVAHPHTKNTQMY-ILXRZTDVSA-N 1 1 349.450 4.038 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](OC3CCC3)CC2)cc1Cl ZINC000872259355 1054427990 /nfs/dbraw/zinc/42/79/90/1054427990.db2.gz UFVHDNFZGCSUIY-OAHLLOKOSA-N 1 1 338.835 4.172 20 5 EIBDMO Cc1cscc1C[NH2+]Cc1c(Br)cccc1[N+](=O)[O-] ZINC001202234709 1055110977 /nfs/dbraw/zinc/11/09/77/1055110977.db2.gz WFKLMZZXDGZQRS-UHFFFAOYSA-N 1 1 341.230 4.017 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCCCC[C@H]2c2ccccc2)cc1 ZINC000776279762 1055153898 /nfs/dbraw/zinc/15/38/98/1055153898.db2.gz YUOPUQMZTAEIDG-VQTJNVASSA-N 1 1 340.423 4.246 20 5 EIBDMO C[C@H](c1cc2ccccc2o1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776280464 1055155236 /nfs/dbraw/zinc/15/52/36/1055155236.db2.gz ZXWCSKWPLMDGPT-CXAGYDPISA-N 1 1 340.379 4.067 20 5 EIBDMO CC(C)C[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CCCC1 ZINC000878010258 1055173562 /nfs/dbraw/zinc/17/35/62/1055173562.db2.gz LZMXZFZJICJMSU-UHFFFAOYSA-N 1 1 344.415 4.045 20 5 EIBDMO CC[C@H](C)[C@@H](C)[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000878057914 1055181789 /nfs/dbraw/zinc/18/17/89/1055181789.db2.gz RDQKAGGDKYZORV-QWHCGFSZSA-N 1 1 344.415 4.044 20 5 EIBDMO CC(C)(C)[C@@H](NCc1cc([O-])ccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000553370766 1055430131 /nfs/dbraw/zinc/43/01/31/1055430131.db2.gz JOQDGABRRHQNBA-KRWDZBQOSA-N 1 1 332.375 4.317 20 5 EIBDMO COc1ccccc1[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000542701151 1055843026 /nfs/dbraw/zinc/84/30/26/1055843026.db2.gz ZNRGLAAJIHZRFG-GOSISDBHSA-N 1 1 326.396 4.249 20 5 EIBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273538508 1055921439 /nfs/dbraw/zinc/92/14/39/1055921439.db2.gz SOTFAEKNILFVLU-PKOBYXMFSA-N 1 1 344.386 4.086 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+]Cc2c(Cl)n[nH]c2C2CC2)cc1[N+](=O)[O-] ZINC000921818890 1056640804 /nfs/dbraw/zinc/64/08/04/1056640804.db2.gz TWXNYEMDHQDJNX-JTQLQIEISA-N 1 1 334.807 4.008 20 5 EIBDMO C[C@H]1C[C@H](c2ccccc2F)[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000743856134 1059162995 /nfs/dbraw/zinc/16/29/95/1059162995.db2.gz HDDDYOOHGIJFES-KPZWWZAWSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@H]1C[C@H](c2ccccc2F)[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000743856134 1059163011 /nfs/dbraw/zinc/16/30/11/1059163011.db2.gz HDDDYOOHGIJFES-KPZWWZAWSA-N 1 1 332.350 4.456 20 5 EIBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000743869610 1059184623 /nfs/dbraw/zinc/18/46/23/1059184623.db2.gz SKFQPYOPDHNFNX-OCCSQVGLSA-N 1 1 328.865 4.354 20 5 EIBDMO C[C@]1(Cc2ccccc2)CCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC001168967987 1060561474 /nfs/dbraw/zinc/56/14/74/1060561474.db2.gz CNYGAIQBSMRECL-HXUWFJFHSA-N 1 1 340.423 4.071 20 5 EIBDMO C[C@@]12c3ccccc3[C@@H](Cc3ccccc31)[N@@H+]2[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169047470 1060603317 /nfs/dbraw/zinc/60/33/17/1060603317.db2.gz RFGBGFIEVOMLJA-FVFSHSICSA-N 1 1 348.446 4.308 20 5 EIBDMO C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c3c2CC[N@H+](C)C3)c2ccccc21 ZINC001169379958 1060792188 /nfs/dbraw/zinc/79/21/88/1060792188.db2.gz PAMIRJOYZRZLTE-ORAYPTAESA-N 1 1 337.423 4.243 20 5 EIBDMO C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c3c2CC[N@@H+](C)C3)c2ccccc21 ZINC001169379958 1060792203 /nfs/dbraw/zinc/79/22/03/1060792203.db2.gz PAMIRJOYZRZLTE-ORAYPTAESA-N 1 1 337.423 4.243 20 5 EIBDMO CC(=O)N1CC[C@@H]([N@@H+](C)Cc2c3ccccc3cc3ccccc32)C1 ZINC001169556581 1060856611 /nfs/dbraw/zinc/85/66/11/1060856611.db2.gz RQLBFRZWAGBNGK-LJQANCHMSA-N 1 1 332.447 4.046 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCCC[C@H]1c1ccco1 ZINC000078831067 217130222 /nfs/dbraw/zinc/13/02/22/217130222.db2.gz SLCPDCWAKVBHAE-INIZCTEOSA-N 1 1 330.384 4.314 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCCC[C@H]1c1ccco1 ZINC000078831067 217130224 /nfs/dbraw/zinc/13/02/24/217130224.db2.gz SLCPDCWAKVBHAE-INIZCTEOSA-N 1 1 330.384 4.314 20 5 EIBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC001307494061 1032201851 /nfs/dbraw/zinc/20/18/51/1032201851.db2.gz CUGFEVHLMVLCHA-JSGCOSHPSA-N 1 1 328.865 4.354 20 5 EIBDMO COc1ccc(-c2ccc(CNc3[nH+]cccc3C)o2)c([N+](=O)[O-])c1 ZINC000533191547 1032530229 /nfs/dbraw/zinc/53/02/29/1032530229.db2.gz LTBBBEBZDSRIJM-UHFFFAOYSA-N 1 1 339.351 4.179 20 5 EIBDMO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000533289466 1032604278 /nfs/dbraw/zinc/60/42/78/1032604278.db2.gz LOZVYPZBSQJYEB-BBRMVZONSA-N 1 1 344.415 4.045 20 5 EIBDMO COc1ccc(C[N@H+]2CC[C@H](c3ccccc3)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000610216033 1019387450 /nfs/dbraw/zinc/38/74/50/1019387450.db2.gz DVUGPMRKZXBFST-YJBOKZPZSA-N 1 1 340.423 4.229 20 5 EIBDMO CCOc1ccccc1[C@H](CC)[NH2+]Cc1ccc([N+](=O)[O-])cc1OC ZINC000430221864 1019481502 /nfs/dbraw/zinc/48/15/02/1019481502.db2.gz URECEBDRZDZJCY-KRWDZBQOSA-N 1 1 344.411 4.243 20 5 EIBDMO O=[N+]([O-])c1ccc(NC[C@@H](c2ccco2)[NH+]2CCCCC2)c(Cl)c1 ZINC000015170582 1019650016 /nfs/dbraw/zinc/65/00/16/1019650016.db2.gz RIACUPGDYPYTIA-INIZCTEOSA-N 1 1 349.818 4.480 20 5 EIBDMO CC[C@@H]1CCC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000246994350 1020322276 /nfs/dbraw/zinc/32/22/76/1020322276.db2.gz GIUUGRTTXMDZKM-ZIAGYGMSSA-N 1 1 344.415 4.218 20 5 EIBDMO CC[C@@H]1CCCC[N@@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC001167158701 1020434890 /nfs/dbraw/zinc/43/48/90/1020434890.db2.gz WXRPZJDZQWFWQR-LLVKDONJSA-N 1 1 327.222 4.122 20 5 EIBDMO CC[C@@H]1CCCC[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC001167158701 1020434896 /nfs/dbraw/zinc/43/48/96/1020434896.db2.gz WXRPZJDZQWFWQR-LLVKDONJSA-N 1 1 327.222 4.122 20 5 EIBDMO C[N@H+]1CCC[C@H](CNc2ccsc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000610281327 1020966166 /nfs/dbraw/zinc/96/61/66/1020966166.db2.gz MWHWVYQXOJYLIN-RISCZKNCSA-N 1 1 337.470 4.213 20 5 EIBDMO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083168914 1021021218 /nfs/dbraw/zinc/02/12/18/1021021218.db2.gz VWEGWJMNKSTQIM-QGZVFWFLSA-N 1 1 337.379 4.382 20 5 EIBDMO CCC[N@@H+](CCc1cccc(F)c1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC001167367320 1021756846 /nfs/dbraw/zinc/75/68/46/1021756846.db2.gz HOKLWBGFGIKUGG-UHFFFAOYSA-N 1 1 334.366 4.328 20 5 EIBDMO CC(C)c1ccc(C[NH2+][C@H](c2ccccc2F)[C@H](C)O)cc1[N+](=O)[O-] ZINC000582185601 1021930015 /nfs/dbraw/zinc/93/00/15/1021930015.db2.gz RWUBSJVUJHPIJY-DJJJIMSYSA-N 1 1 346.402 4.069 20 5 EIBDMO C[C@@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1nc2c(s1)CCC2 ZINC000414159183 1021992883 /nfs/dbraw/zinc/99/28/83/1021992883.db2.gz VSZGHLDTUUPSTO-IAQYHMDHSA-N 1 1 343.452 4.268 20 5 EIBDMO Cc1nc2c(s1)[C@H]([N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-])CCC2 ZINC000255524105 1022029575 /nfs/dbraw/zinc/02/95/75/1022029575.db2.gz MZXOWNKYICRHEQ-BQLWYNFJSA-N 1 1 343.452 4.382 20 5 EIBDMO CC(C)CC[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001167906749 1033030752 /nfs/dbraw/zinc/03/07/52/1033030752.db2.gz ZRIOQRKVSHQAAL-OAHLLOKOSA-N 1 1 335.404 4.294 20 5 EIBDMO CC(C)[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CCCCC1 ZINC000102768822 1022166749 /nfs/dbraw/zinc/16/67/49/1022166749.db2.gz APJKVZUMBXHHJA-UHFFFAOYSA-N 1 1 334.416 4.004 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC(c2ccccn2)CC1 ZINC000378260889 1022581101 /nfs/dbraw/zinc/58/11/01/1022581101.db2.gz RBTGFYAFBJHDMI-UHFFFAOYSA-N 1 1 331.803 4.023 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@@H]3CCCC[C@H]3F)cs2)c1 ZINC000414511122 1023246392 /nfs/dbraw/zinc/24/63/92/1023246392.db2.gz JTORHVRTWIYOQJ-HUUCEWRRSA-N 1 1 335.404 4.089 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@H]1CCOc2ccc(F)cc21 ZINC000893866480 1033131504 /nfs/dbraw/zinc/13/15/04/1033131504.db2.gz HZQAYISKKXZVPS-AWEZNQCLSA-N 1 1 336.750 4.001 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@H]1CCC2(CCCC2)O1)C1CC1 ZINC000581619914 1023430798 /nfs/dbraw/zinc/43/07/98/1023430798.db2.gz XOQXXJDVIAXARJ-QGZVFWFLSA-N 1 1 330.428 4.051 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@H]1CCC2(CCCC2)O1)C1CC1 ZINC000581619914 1023430815 /nfs/dbraw/zinc/43/08/15/1023430815.db2.gz XOQXXJDVIAXARJ-QGZVFWFLSA-N 1 1 330.428 4.051 20 5 EIBDMO CC[C@@H](C)[C@H](C)[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000566519257 1023445781 /nfs/dbraw/zinc/44/57/81/1023445781.db2.gz IENNQEDZMBTLPV-HIFRSBDPSA-N 1 1 347.459 4.131 20 5 EIBDMO COc1ccc2oc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])cc2c1 ZINC000581693810 1023613296 /nfs/dbraw/zinc/61/32/96/1023613296.db2.gz PNCOGDGBKMRFKH-UHFFFAOYSA-N 1 1 340.379 4.024 20 5 EIBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1CCC2(CCCC2)C1 ZINC001167487485 1023831379 /nfs/dbraw/zinc/83/13/79/1023831379.db2.gz NQLZVJXPHNVXAS-UHFFFAOYSA-N 1 1 339.233 4.123 20 5 EIBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CCC2(CCCC2)C1 ZINC001167487485 1023831381 /nfs/dbraw/zinc/83/13/81/1023831381.db2.gz NQLZVJXPHNVXAS-UHFFFAOYSA-N 1 1 339.233 4.123 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H](c4cccnc4)C3)o2)cc1 ZINC000581944283 1023920472 /nfs/dbraw/zinc/92/04/72/1023920472.db2.gz AWNGSOBTYTWUMN-QGZVFWFLSA-N 1 1 349.390 4.239 20 5 EIBDMO CC1=C[C@@H](C)C[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000430878354 1024168585 /nfs/dbraw/zinc/16/85/85/1024168585.db2.gz NOKBEEVSUYUYCO-GFCCVEGCSA-N 1 1 329.425 4.116 20 5 EIBDMO CC1=C[C@@H](C)C[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000430878354 1024168631 /nfs/dbraw/zinc/16/86/31/1024168631.db2.gz NOKBEEVSUYUYCO-GFCCVEGCSA-N 1 1 329.425 4.116 20 5 EIBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])s2)cc1 ZINC000610915066 1025135057 /nfs/dbraw/zinc/13/50/57/1025135057.db2.gz OXQUQYCQKPDTPW-LLVKDONJSA-N 1 1 328.397 4.324 20 5 EIBDMO C[C@@H]([NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccncc1F ZINC000511034277 1025765498 /nfs/dbraw/zinc/76/54/98/1025765498.db2.gz QXCJRWYOILFQNH-DIFFPNOSSA-N 1 1 329.375 4.202 20 5 EIBDMO Cc1c(C[N@H+](Cc2ccccc2)C[C@@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000071958736 1025884294 /nfs/dbraw/zinc/88/42/94/1025884294.db2.gz IYLGCVUBGQQBBW-IBGZPJMESA-N 1 1 340.423 4.084 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](c3nccs3)C2)c(Cl)c1 ZINC000182106920 1026263934 /nfs/dbraw/zinc/26/39/34/1026263934.db2.gz OVJLSKXMVHMPML-GFCCVEGCSA-N 1 1 337.832 4.084 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3nccs3)C2)c(Cl)c1 ZINC000182106920 1026263948 /nfs/dbraw/zinc/26/39/48/1026263948.db2.gz OVJLSKXMVHMPML-GFCCVEGCSA-N 1 1 337.832 4.084 20 5 EIBDMO C[C@@H]1CCCCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000512204281 1026461632 /nfs/dbraw/zinc/46/16/32/1026461632.db2.gz UTQRVIAHMYDMHI-CQSZACIVSA-N 1 1 329.400 4.057 20 5 EIBDMO COc1ccc2c(c1)CCC[C@@H]2[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000507142205 1026659963 /nfs/dbraw/zinc/65/99/63/1026659963.db2.gz IYHSVUUBOHSXSQ-IBGZPJMESA-N 1 1 326.396 4.113 20 5 EIBDMO COc1ccc2c(c1)CCC[C@H]2[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000507142206 1026660338 /nfs/dbraw/zinc/66/03/38/1026660338.db2.gz IYHSVUUBOHSXSQ-LJQANCHMSA-N 1 1 326.396 4.113 20 5 EIBDMO COc1ccc([C@@H]2CC[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])C2)cc1 ZINC000512339358 1026740297 /nfs/dbraw/zinc/74/02/97/1026740297.db2.gz UMSLFHLANMFLBP-MJICGBHWSA-N 1 1 338.407 4.106 20 5 EIBDMO CC(C)(C)OCc1cccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC000479919847 1026911785 /nfs/dbraw/zinc/91/17/85/1026911785.db2.gz FJEDGPYYJROEHR-UHFFFAOYSA-N 1 1 346.402 4.339 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@H]2CCCC[C@H]12 ZINC000543907231 1027442676 /nfs/dbraw/zinc/44/26/76/1027442676.db2.gz XNOQVEVQOJNUSC-XWIAVFTESA-N 1 1 341.411 4.260 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCSc2ccc(F)cc21 ZINC000178728078 1027781543 /nfs/dbraw/zinc/78/15/43/1027781543.db2.gz XFTITRWWBVGWLG-OAHLLOKOSA-N 1 1 348.399 4.069 20 5 EIBDMO Cc1ccccc1[C@H]1C[N@H+](Cc2cccc([N+](=O)[O-])c2C)[C@@H](C)CO1 ZINC000441436356 1027895691 /nfs/dbraw/zinc/89/56/91/1027895691.db2.gz GQTWKQZNIOIFEW-MGPUTAFESA-N 1 1 340.423 4.174 20 5 EIBDMO Cc1ccccc1[C@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2C)[C@@H](C)CO1 ZINC000441436356 1027895693 /nfs/dbraw/zinc/89/56/93/1027895693.db2.gz GQTWKQZNIOIFEW-MGPUTAFESA-N 1 1 340.423 4.174 20 5 EIBDMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000444675374 1027958682 /nfs/dbraw/zinc/95/86/82/1027958682.db2.gz LWGOMLJRJCYQEH-CJNGLKHVSA-N 1 1 344.415 4.045 20 5 EIBDMO C/C(=C\c1ccccc1)C[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444708392 1028001523 /nfs/dbraw/zinc/00/15/23/1028001523.db2.gz QOHYQULYFQTSRW-GXDHUFHOSA-N 1 1 336.395 4.006 20 5 EIBDMO C/C(=C\c1ccccc1)C[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444708392 1028001545 /nfs/dbraw/zinc/00/15/45/1028001545.db2.gz QOHYQULYFQTSRW-GXDHUFHOSA-N 1 1 336.395 4.006 20 5 EIBDMO Cc1ccc(C)c([C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)[C@H](C)CO2)c1 ZINC000441461896 1028069555 /nfs/dbraw/zinc/06/95/55/1028069555.db2.gz HRTZTGWQBKRZRK-UZLBHIALSA-N 1 1 340.423 4.174 20 5 EIBDMO Cc1ccc(C)c([C@@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)[C@H](C)CO2)c1 ZINC000441461896 1028069577 /nfs/dbraw/zinc/06/95/77/1028069577.db2.gz HRTZTGWQBKRZRK-UZLBHIALSA-N 1 1 340.423 4.174 20 5 EIBDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000536365482 1028157903 /nfs/dbraw/zinc/15/79/03/1028157903.db2.gz LHOJEYGQXNUHDY-XUWXXGDYSA-N 1 1 341.411 4.403 20 5 EIBDMO COc1ccc(C[N@@H+]2CCCCC[C@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000523009217 1029395926 /nfs/dbraw/zinc/39/59/26/1029395926.db2.gz SHJBIDZPZAKALU-HNNXBMFYSA-N 1 1 330.384 4.314 20 5 EIBDMO COc1ccc(C[N@H+]2CCCCC[C@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000523009217 1029395934 /nfs/dbraw/zinc/39/59/34/1029395934.db2.gz SHJBIDZPZAKALU-HNNXBMFYSA-N 1 1 330.384 4.314 20 5 EIBDMO CC[C@@H](O)C[N@H+](Cc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000441067398 1029508325 /nfs/dbraw/zinc/50/83/25/1029508325.db2.gz QNFOHBKFBYBDHQ-QGZVFWFLSA-N 1 1 348.830 4.021 20 5 EIBDMO CC[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000441067398 1029508332 /nfs/dbraw/zinc/50/83/32/1029508332.db2.gz QNFOHBKFBYBDHQ-QGZVFWFLSA-N 1 1 348.830 4.021 20 5 EIBDMO C[C@]1(O)CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000475342884 1029557646 /nfs/dbraw/zinc/55/76/46/1029557646.db2.gz MFXBJURSOVYDGC-SFHVURJKSA-N 1 1 346.452 4.060 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@@H](CSc2ccccc2)C1 ZINC000525779412 1030013822 /nfs/dbraw/zinc/01/38/22/1030013822.db2.gz HWLJIKJCLODYAR-OAHLLOKOSA-N 1 1 328.437 4.209 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1COc3ccc(Cl)cc31)CCC2 ZINC000447583424 1030181384 /nfs/dbraw/zinc/18/13/84/1030181384.db2.gz BKFHWZOWKSZZPQ-SJORKVTESA-N 1 1 344.798 4.349 20 5 EIBDMO CC(C)([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1Br ZINC000179329597 1030910586 /nfs/dbraw/zinc/91/05/86/1030910586.db2.gz QBDMRSHFNRJNAV-UHFFFAOYSA-N 1 1 349.228 4.382 20 5 EIBDMO C[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc(OC(F)F)cc1 ZINC000179611101 1031226253 /nfs/dbraw/zinc/22/62/53/1031226253.db2.gz NJYPPNWUPOFEQD-SNVBAGLBSA-N 1 1 340.301 4.186 20 5 EIBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@H](C)Cc1ccsc1 ZINC000614604119 1031270146 /nfs/dbraw/zinc/27/01/46/1031270146.db2.gz VHAQNZMQTYCBBA-GFCCVEGCSA-N 1 1 345.424 4.251 20 5 EIBDMO CC(C)COC[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1ccco1 ZINC000236628902 1031565174 /nfs/dbraw/zinc/56/51/74/1031565174.db2.gz UTDWUKIQKBMNFL-JZLODUJNSA-N 1 1 344.411 4.205 20 5 EIBDMO COc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2Cl)cc1[N+](=O)[O-] ZINC000449347157 1031643889 /nfs/dbraw/zinc/64/38/89/1031643889.db2.gz FZHVFKVBGWGFIS-SNVBAGLBSA-N 1 1 338.766 4.247 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCS[C@H](c2ccccc2)C1 ZINC000612577464 1031672418 /nfs/dbraw/zinc/67/24/18/1031672418.db2.gz SDQSDZFXGMVKQJ-SFHVURJKSA-N 1 1 328.437 4.193 20 5 EIBDMO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000449461151 1031778644 /nfs/dbraw/zinc/77/86/44/1031778644.db2.gz OPXPJAARBXVYJX-LJXYTEIVSA-N 1 1 328.334 4.271 20 5 EIBDMO C[C@H]1CCCC[N@@H+]1CCC1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000531910556 1031806087 /nfs/dbraw/zinc/80/60/87/1031806087.db2.gz MHHWVFVFDNWXOU-KRWDZBQOSA-N 1 1 345.487 4.071 20 5 EIBDMO C[C@H]1CCCC[N@H+]1CCC1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000531910556 1031806095 /nfs/dbraw/zinc/80/60/95/1031806095.db2.gz MHHWVFVFDNWXOU-KRWDZBQOSA-N 1 1 345.487 4.071 20 5 EIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+](Cc1cccc(O)c1)CC1CC1 ZINC000512682937 1033699494 /nfs/dbraw/zinc/69/94/94/1033699494.db2.gz KRJCIMFYYYTHEW-DAXSKMNVSA-N 1 1 338.407 4.226 20 5 EIBDMO C[C@H]1CC[C@H]([N@@H+](C)Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000433040096 1033711718 /nfs/dbraw/zinc/71/17/18/1033711718.db2.gz QVRSSHPZEUMFAJ-WFASDCNBSA-N 1 1 331.441 4.339 20 5 EIBDMO CC(C)[N@@H+]1CCC[C@@H](CN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433172792 1033991635 /nfs/dbraw/zinc/99/16/35/1033991635.db2.gz DMIDMUCHSUUPFY-HNAYVOBHSA-N 1 1 345.487 4.027 20 5 EIBDMO CC(C)[N@H+]1CCC[C@@H](CN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433172792 1033991643 /nfs/dbraw/zinc/99/16/43/1033991643.db2.gz DMIDMUCHSUUPFY-HNAYVOBHSA-N 1 1 345.487 4.027 20 5 EIBDMO Cc1ccccc1[C@H]1C[C@H](C)[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000738312441 1034811631 /nfs/dbraw/zinc/81/16/31/1034811631.db2.gz OKNJWKLHEWEJSU-GJZGRUSLSA-N 1 1 328.387 4.420 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1COc2c1ccc(C)c2C ZINC000595013054 1035505418 /nfs/dbraw/zinc/50/54/18/1035505418.db2.gz GJEJKSUSJSIQAE-SUMWQHHRSA-N 1 1 342.395 4.005 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccccc1OC(C)C ZINC000595016275 1035508948 /nfs/dbraw/zinc/50/89/48/1035508948.db2.gz JOZVOJZPVWYCGB-CQSZACIVSA-N 1 1 344.411 4.241 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1(c2cccc(F)c2)CC1 ZINC000595024197 1035510444 /nfs/dbraw/zinc/51/04/44/1035510444.db2.gz YNLMKDLKYCWWGX-LBPRGKRZSA-N 1 1 330.359 4.082 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cccc(OC2CC2)c1F ZINC000595069013 1035550607 /nfs/dbraw/zinc/55/06/07/1035550607.db2.gz MGRADOOHFKAONB-ZDUSSCGKSA-N 1 1 344.386 4.434 20 5 EIBDMO CC[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC)c1c(C)noc1C ZINC000595035763 1035562747 /nfs/dbraw/zinc/56/27/47/1035562747.db2.gz MFGKLJIKANYQNP-BMIGLBTASA-N 1 1 333.388 4.010 20 5 EIBDMO COc1ccc([C@@H]2CCCCC[N@@H+]2Cc2onc(C)c2[N+](=O)[O-])cc1 ZINC000595286167 1035631669 /nfs/dbraw/zinc/63/16/69/1035631669.db2.gz DGZRYNZGQIMKTM-INIZCTEOSA-N 1 1 345.399 4.017 20 5 EIBDMO COc1ccc([C@@H]2CCCCC[N@H+]2Cc2onc(C)c2[N+](=O)[O-])cc1 ZINC000595286167 1035631682 /nfs/dbraw/zinc/63/16/82/1035631682.db2.gz DGZRYNZGQIMKTM-INIZCTEOSA-N 1 1 345.399 4.017 20 5 EIBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000595318278 1035640781 /nfs/dbraw/zinc/64/07/81/1035640781.db2.gz IGLLJASMTVBBSS-QGZVFWFLSA-N 1 1 332.400 4.024 20 5 EIBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000595318278 1035640806 /nfs/dbraw/zinc/64/08/06/1035640806.db2.gz IGLLJASMTVBBSS-QGZVFWFLSA-N 1 1 332.400 4.024 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1ccccc1OC(F)F ZINC000595409200 1035674304 /nfs/dbraw/zinc/67/43/04/1035674304.db2.gz BDVYEBTYTTUCOS-SNVBAGLBSA-N 1 1 340.301 4.186 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC([C@H]3CCCCO3)CC2)c(Cl)c1 ZINC000595781188 1035791362 /nfs/dbraw/zinc/79/13/62/1035791362.db2.gz AGBVQJSMDHZAMU-QGZVFWFLSA-N 1 1 338.835 4.029 20 5 EIBDMO C[C@@H]([NH2+][C@@H]1CCc2ccccc2-n2ccnc21)c1ccc([N+](=O)[O-])cc1 ZINC000596094002 1035820812 /nfs/dbraw/zinc/82/08/12/1035820812.db2.gz FZLRPAXRISVVGU-RDTXWAMCSA-N 1 1 348.406 4.119 20 5 EIBDMO O=[N+]([O-])c1cc(C(F)F)ccc1NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596571582 1035898719 /nfs/dbraw/zinc/89/87/19/1035898719.db2.gz WUQJPVDSGWHKLW-CYBMUJFWSA-N 1 1 339.386 4.066 20 5 EIBDMO CC(C)[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)c1ccsc1 ZINC000421008281 1035951210 /nfs/dbraw/zinc/95/12/10/1035951210.db2.gz LWMGEJVXEBRWBT-CYBMUJFWSA-N 1 1 347.440 4.066 20 5 EIBDMO CC(C)[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)c1ccsc1 ZINC000421008281 1035951269 /nfs/dbraw/zinc/95/12/69/1035951269.db2.gz LWMGEJVXEBRWBT-CYBMUJFWSA-N 1 1 347.440 4.066 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)ccc1Br ZINC000227987486 1036032308 /nfs/dbraw/zinc/03/23/08/1036032308.db2.gz FZYLKPNPTSKSED-GXTWGEPZSA-N 1 1 339.233 4.122 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)ccc1Br ZINC000227987486 1036032332 /nfs/dbraw/zinc/03/23/32/1036032332.db2.gz FZYLKPNPTSKSED-GXTWGEPZSA-N 1 1 339.233 4.122 20 5 EIBDMO COc1cc(C[N@H+]2CC=C(c3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000485803405 1036288157 /nfs/dbraw/zinc/28/81/57/1036288157.db2.gz XPIVOZQCSCYEFS-UHFFFAOYSA-N 1 1 342.370 4.032 20 5 EIBDMO COc1cc(C[N@@H+]2CC=C(c3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000485803405 1036288176 /nfs/dbraw/zinc/28/81/76/1036288176.db2.gz XPIVOZQCSCYEFS-UHFFFAOYSA-N 1 1 342.370 4.032 20 5 EIBDMO COc1cc(C[N@@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc(OC)c1 ZINC000485819205 1036301837 /nfs/dbraw/zinc/30/18/37/1036301837.db2.gz AOJABAKQAKIKRK-AWEZNQCLSA-N 1 1 344.411 4.113 20 5 EIBDMO COc1ccc(C[N@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)cc1F ZINC000761244268 1036367128 /nfs/dbraw/zinc/36/71/28/1036367128.db2.gz RNIRCXAWXLEWEX-UHFFFAOYSA-N 1 1 338.766 4.028 20 5 EIBDMO COc1ccc(C[N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)cc1F ZINC000761244268 1036367146 /nfs/dbraw/zinc/36/71/46/1036367146.db2.gz RNIRCXAWXLEWEX-UHFFFAOYSA-N 1 1 338.766 4.028 20 5 EIBDMO CC[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C[C@@H](O)c1ccc(C)cc1 ZINC000761254301 1036455905 /nfs/dbraw/zinc/45/59/05/1036455905.db2.gz UIWFOQOKKYLXLC-GOSISDBHSA-N 1 1 348.830 4.112 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3ccc(C(F)F)nc3)C2)cc1 ZINC000602686486 1036562703 /nfs/dbraw/zinc/56/27/03/1036562703.db2.gz VXHLIIVNFFNVCY-HNNXBMFYSA-N 1 1 347.365 4.307 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](c2ccc3cccnc3n2)C1 ZINC000602886121 1036660615 /nfs/dbraw/zinc/66/06/15/1036660615.db2.gz HBOVWDSAJKYDTE-HOCLYGCPSA-N 1 1 348.406 4.089 20 5 EIBDMO CCC[C@H](C)[C@@H]1CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000486780495 1036851544 /nfs/dbraw/zinc/85/15/44/1036851544.db2.gz VMPZCYFKJDFLQR-BBRMVZONSA-N 1 1 344.415 4.045 20 5 EIBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000603859485 1037053674 /nfs/dbraw/zinc/05/36/74/1037053674.db2.gz BOGIKCVYHYRMTN-OAHLLOKOSA-N 1 1 342.443 4.210 20 5 EIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)c1 ZINC000599552878 1037072625 /nfs/dbraw/zinc/07/26/25/1037072625.db2.gz KGHRUCYQXNUJJV-OLZOCXBDSA-N 1 1 346.374 4.084 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3cc4ccccc4[nH]3)C2)cc1 ZINC000603889992 1037077831 /nfs/dbraw/zinc/07/78/31/1037077831.db2.gz JFYHKSFNZSAINO-QGZVFWFLSA-N 1 1 335.407 4.456 20 5 EIBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@@H](c3cc4ccccc4[nH]3)C2)cc1 ZINC000603890325 1037078106 /nfs/dbraw/zinc/07/81/06/1037078106.db2.gz ZVBXLIAZBAENAF-GOSISDBHSA-N 1 1 349.434 4.498 20 5 EIBDMO Cc1c(C[N@H+](Cc2ccccc2F)CC2CC2)cccc1[N+](=O)[O-] ZINC000604291719 1037308976 /nfs/dbraw/zinc/30/89/76/1037308976.db2.gz YEIAAHCFQYKVLH-UHFFFAOYSA-N 1 1 328.387 4.455 20 5 EIBDMO CC(C)[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1cccs1 ZINC000604415161 1037383635 /nfs/dbraw/zinc/38/36/35/1037383635.db2.gz BMPSVJVGYGFSLC-UHFFFAOYSA-N 1 1 334.441 4.336 20 5 EIBDMO CCC[N@@H+](Cc1ccc(OC)cc1)Cc1cc([N+](=O)[O-])ccc1OC ZINC000604492849 1037408330 /nfs/dbraw/zinc/40/83/30/1037408330.db2.gz HPYJBJFLDSKLKC-UHFFFAOYSA-N 1 1 344.411 4.024 20 5 EIBDMO C[C@@H]1CSCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000488372724 1037550145 /nfs/dbraw/zinc/55/01/45/1037550145.db2.gz UVLNXMNNYVUYEZ-ZDUSSCGKSA-N 1 1 332.425 4.040 20 5 EIBDMO 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ZINC000490028234 1038309330 /nfs/dbraw/zinc/30/93/30/1038309330.db2.gz GKWLXFNSCVMEHR-INIZCTEOSA-N 1 1 328.412 4.113 20 5 EIBDMO COc1ccccc1[C@@H]1CC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000490034225 1038313739 /nfs/dbraw/zinc/31/37/39/1038313739.db2.gz UQIDPZIJPIELFS-JKSUJKDBSA-N 1 1 340.423 4.462 20 5 EIBDMO COc1cc(C[N@@H+]2CC[C@H](C)C[C@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000490067080 1038332558 /nfs/dbraw/zinc/33/25/58/1038332558.db2.gz LUALNFKOGBVNPF-BBRMVZONSA-N 1 1 330.384 4.170 20 5 EIBDMO COc1cc(C[N@H+]2CC[C@H](C)C[C@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000490067080 1038332576 /nfs/dbraw/zinc/33/25/76/1038332576.db2.gz LUALNFKOGBVNPF-BBRMVZONSA-N 1 1 330.384 4.170 20 5 EIBDMO CC[C@@H]1c2ccsc2CC[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000059384340 1038557101 /nfs/dbraw/zinc/55/71/01/1038557101.db2.gz WOEVPBNHRNPBQL-CQSZACIVSA-N 1 1 332.425 4.045 20 5 EIBDMO C[C@@H](O)C[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000537623382 1039005274 /nfs/dbraw/zinc/00/52/74/1039005274.db2.gz DSBDKBGFJGGHSZ-CJNGLKHVSA-N 1 1 346.452 4.059 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CC(c2nc3ccccc3s2)C1 ZINC000534215660 1039221421 /nfs/dbraw/zinc/22/14/21/1039221421.db2.gz HPUNKCQZMWTUOE-GFCCVEGCSA-N 1 1 339.420 4.365 20 5 EIBDMO Cc1nc(C(C)C)ccc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000555523669 1039336220 /nfs/dbraw/zinc/33/62/20/1039336220.db2.gz VARXVSJVVYNHMH-UHFFFAOYSA-N 1 1 327.428 4.096 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](COCc2ccccc2)C1 ZINC000075865024 1039771698 /nfs/dbraw/zinc/77/16/98/1039771698.db2.gz GCAUREKPPQTOEH-AEFFLSMTSA-N 1 1 340.423 4.195 20 5 EIBDMO C[C@]12CC[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C[C@H]1C2(F)F ZINC000430104260 1039837044 /nfs/dbraw/zinc/83/70/44/1039837044.db2.gz LTYMPDVCQPUQTP-SJORKVTESA-N 1 1 348.349 4.332 20 5 EIBDMO C[N@@H+](Cc1ccc[nH]1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000537658899 1039860805 /nfs/dbraw/zinc/86/08/05/1039860805.db2.gz CFJIBEWWASTXML-UHFFFAOYSA-N 1 1 327.409 4.283 20 5 EIBDMO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccc(Cl)cc1 ZINC000434833765 1039879537 /nfs/dbraw/zinc/87/95/37/1039879537.db2.gz MLRVEXXILNEHGP-UHFFFAOYSA-N 1 1 345.786 4.412 20 5 EIBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccc(Cl)cc1 ZINC000434833765 1039879541 /nfs/dbraw/zinc/87/95/41/1039879541.db2.gz MLRVEXXILNEHGP-UHFFFAOYSA-N 1 1 345.786 4.412 20 5 EIBDMO Cc1ccoc1C[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000430135383 1040119932 /nfs/dbraw/zinc/11/99/32/1040119932.db2.gz TYQRWAVTOKFJPM-UHFFFAOYSA-N 1 1 326.352 4.388 20 5 EIBDMO Cc1ccoc1C[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000430135383 1040119948 /nfs/dbraw/zinc/11/99/48/1040119948.db2.gz TYQRWAVTOKFJPM-UHFFFAOYSA-N 1 1 326.352 4.388 20 5 EIBDMO CCC[C@@H](N[C@@H]1CC[N@@H+](C2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000482638615 1040403189 /nfs/dbraw/zinc/40/31/89/1040403189.db2.gz BHPDNUFWTLSHPH-VQIMIIECSA-N 1 1 331.460 4.043 20 5 EIBDMO CCC[C@@H](N[C@@H]1CC[N@H+](C2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000482638615 1040403191 /nfs/dbraw/zinc/40/31/91/1040403191.db2.gz BHPDNUFWTLSHPH-VQIMIIECSA-N 1 1 331.460 4.043 20 5 EIBDMO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000482695030 1040433036 /nfs/dbraw/zinc/43/30/36/1040433036.db2.gz MXURUNDOTNXAKN-SFHVURJKSA-N 1 1 336.395 4.117 20 5 EIBDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000482695030 1040433039 /nfs/dbraw/zinc/43/30/39/1040433039.db2.gz MXURUNDOTNXAKN-SFHVURJKSA-N 1 1 336.395 4.117 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+](CC3CC3)C3CCC3)co2)cc1 ZINC000483316333 1040816374 /nfs/dbraw/zinc/81/63/74/1040816374.db2.gz SZJRSHGBRKTUOO-UHFFFAOYSA-N 1 1 327.384 4.014 20 5 EIBDMO C[C@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)c1cccc([N+](=O)[O-])c1 ZINC000537941332 1040905903 /nfs/dbraw/zinc/90/59/03/1040905903.db2.gz PFOLBRIEHXZDSB-ZDUSSCGKSA-N 1 1 329.400 4.018 20 5 EIBDMO Cc1c(C[N@H+]2CCC[C@@H]2Cc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000515744045 1041033983 /nfs/dbraw/zinc/03/39/83/1041033983.db2.gz XHRKKKCFESPLBK-GOSISDBHSA-N 1 1 328.387 4.249 20 5 EIBDMO Cc1c(C[N@H+]2CCC[C@H]2Cc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000515744046 1041034531 /nfs/dbraw/zinc/03/45/31/1041034531.db2.gz XHRKKKCFESPLBK-SFHVURJKSA-N 1 1 328.387 4.249 20 5 EIBDMO CC(C)[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@H]1CCOC1 ZINC000462869229 1041047275 /nfs/dbraw/zinc/04/72/75/1041047275.db2.gz FHSXFSSYISPDSG-CQSZACIVSA-N 1 1 346.452 4.323 20 5 EIBDMO C[C@@H]([NH2+]Cc1cc(-c2ccc(F)cc2)no1)c1cccc([N+](=O)[O-])c1 ZINC000538178069 1041132982 /nfs/dbraw/zinc/13/29/82/1041132982.db2.gz PKRXSGIXBQTAIO-GFCCVEGCSA-N 1 1 341.342 4.240 20 5 EIBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463035507 1041259262 /nfs/dbraw/zinc/25/92/62/1041259262.db2.gz QSPGJLKOSVRSDL-OCCSQVGLSA-N 1 1 334.313 4.287 20 5 EIBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463035507 1041259274 /nfs/dbraw/zinc/25/92/74/1041259274.db2.gz QSPGJLKOSVRSDL-OCCSQVGLSA-N 1 1 334.313 4.287 20 5 EIBDMO Cc1cc(N2CC[C@H](C)[N@H+](Cc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000463071160 1041316602 /nfs/dbraw/zinc/31/66/02/1041316602.db2.gz VXGZXICIGNUXMF-KRWDZBQOSA-N 1 1 339.439 4.004 20 5 EIBDMO COc1cc(C[N@@H+](C)C(C)C)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000505893295 1041538637 /nfs/dbraw/zinc/53/86/37/1041538637.db2.gz COBLHURKFQLCRU-UHFFFAOYSA-N 1 1 344.411 4.023 20 5 EIBDMO COc1ccc(C[N@@H+]2C[C@H](C)C[C@H]2c2ccccc2F)cc1[N+](=O)[O-] ZINC000464725681 1042142798 /nfs/dbraw/zinc/14/27/98/1042142798.db2.gz ORQVTGADNXZRMC-DYVFJYSZSA-N 1 1 344.386 4.326 20 5 EIBDMO COc1ccc(C[N@H+]2C[C@H](C)C[C@H]2c2ccccc2F)cc1[N+](=O)[O-] ZINC000464725681 1042142803 /nfs/dbraw/zinc/14/28/03/1042142803.db2.gz ORQVTGADNXZRMC-DYVFJYSZSA-N 1 1 344.386 4.326 20 5 EIBDMO C[C@@H]1C[C@H](c2ccccc2F)[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000464729245 1042143157 /nfs/dbraw/zinc/14/31/57/1042143157.db2.gz DDMQSTAPTZYJBE-RDTXWAMCSA-N 1 1 344.386 4.196 20 5 EIBDMO C[N@H+](Cc1cccs1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549745878 1042304123 /nfs/dbraw/zinc/30/41/23/1042304123.db2.gz KTYCPNYKTOXDJU-UHFFFAOYSA-N 1 1 330.331 4.307 20 5 EIBDMO C[N@@H+](Cc1cccs1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549745878 1042304130 /nfs/dbraw/zinc/30/41/30/1042304130.db2.gz KTYCPNYKTOXDJU-UHFFFAOYSA-N 1 1 330.331 4.307 20 5 EIBDMO COc1ccc([C@@H](C)[N@@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])cc1 ZINC000506325964 1042315295 /nfs/dbraw/zinc/31/52/95/1042315295.db2.gz OIYWPMHFIYRGIH-DDJMYBDESA-N 1 1 326.396 4.310 20 5 EIBDMO Cc1csc(C2([NH2+][C@H](C)c3cc([N+](=O)[O-])ccc3C)CCC2)n1 ZINC000271933395 1042538375 /nfs/dbraw/zinc/53/83/75/1042538375.db2.gz FFEZLQCOADMDCX-CYBMUJFWSA-N 1 1 331.441 4.398 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)Cc1cccc(N(C)C)c1 ZINC000492825148 1042754815 /nfs/dbraw/zinc/75/48/15/1042754815.db2.gz BWASSXPPBCAGNF-HNNXBMFYSA-N 1 1 327.428 4.162 20 5 EIBDMO COc1ccc([C@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000761507030 1042872570 /nfs/dbraw/zinc/87/25/70/1042872570.db2.gz RHGFMVUKJITZCJ-LBPRGKRZSA-N 1 1 334.803 4.450 20 5 EIBDMO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000611554143 1043047100 /nfs/dbraw/zinc/04/71/00/1043047100.db2.gz GDKVGHJYGUSMTG-CHWSQXEVSA-N 1 1 346.349 4.027 20 5 EIBDMO CC(C)(O)[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000428075587 1043319479 /nfs/dbraw/zinc/31/94/79/1043319479.db2.gz ZUTCONMFTGCLPR-KRWDZBQOSA-N 1 1 346.452 4.059 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1ccc(F)cc1 ZINC000609193196 1043445249 /nfs/dbraw/zinc/44/52/49/1043445249.db2.gz ABCNAWYCYGZNLF-UHFFFAOYSA-N 1 1 332.375 4.153 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1ccc(F)cc1 ZINC000609193196 1043445256 /nfs/dbraw/zinc/44/52/56/1043445256.db2.gz ABCNAWYCYGZNLF-UHFFFAOYSA-N 1 1 332.375 4.153 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2nccc3ccccc32)c1 ZINC000731451382 1043759740 /nfs/dbraw/zinc/75/97/40/1043759740.db2.gz WWPOUJMLFMFQSD-UHFFFAOYSA-N 1 1 327.771 4.086 20 5 EIBDMO C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])c3cnccc23)[C@@H]1c1ccccc1 ZINC000301854516 1043816137 /nfs/dbraw/zinc/81/61/37/1043816137.db2.gz YITFKBCLZGQXKC-ICSRJNTNSA-N 1 1 348.406 4.000 20 5 EIBDMO CC[NH+](CC)Cc1ccccc1CN[C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000079055523 1043835536 /nfs/dbraw/zinc/83/55/36/1043835536.db2.gz APKBUSAVADHYTO-MRXNPFEDSA-N 1 1 341.455 4.287 20 5 EIBDMO CC[N@H+](Cc1c[nH]c2ccccc12)Cc1ccc([N+](=O)[O-])cc1F ZINC000442881847 1043880333 /nfs/dbraw/zinc/88/03/33/1043880333.db2.gz OHJDMTXJZAKSIU-UHFFFAOYSA-N 1 1 327.359 4.237 20 5 EIBDMO CC[N@@H+](Cc1c[nH]c2ccccc12)Cc1ccc([N+](=O)[O-])cc1F ZINC000442881847 1043880336 /nfs/dbraw/zinc/88/03/36/1043880336.db2.gz OHJDMTXJZAKSIU-UHFFFAOYSA-N 1 1 327.359 4.237 20 5 EIBDMO Cc1[nH+]c2cc(Nc3ccc([N+](=O)[O-])c4cccnc34)ccc2n1C ZINC000301959949 1044358899 /nfs/dbraw/zinc/35/88/99/1044358899.db2.gz PRGWHQKBGWGDEM-UHFFFAOYSA-N 1 1 333.351 4.082 20 5 EIBDMO Cc1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cc2cccnc12 ZINC000466472480 1044575499 /nfs/dbraw/zinc/57/54/99/1044575499.db2.gz YMPNSVSWLCABRZ-UHFFFAOYSA-N 1 1 341.798 4.395 20 5 EIBDMO CCCCC[N@@H+](Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)C(C)C ZINC000734828321 1044692389 /nfs/dbraw/zinc/69/23/89/1044692389.db2.gz QZCYRQRVVMCTKW-UHFFFAOYSA-N 1 1 330.432 4.316 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H](c3ccccn3)C3CC3)o2)cc1 ZINC000922586999 1044831483 /nfs/dbraw/zinc/83/14/83/1044831483.db2.gz VFYHLDSWJWJMLK-HXUWFJFHSA-N 1 1 349.390 4.491 20 5 EIBDMO COC[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000093337466 1044831540 /nfs/dbraw/zinc/83/15/40/1044831540.db2.gz BXYJKGNHKYEUMC-CQSZACIVSA-N 1 1 346.452 4.182 20 5 EIBDMO CCS[C@@H]1CCCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000735493298 1044832893 /nfs/dbraw/zinc/83/28/93/1044832893.db2.gz OCAORVVGLCEKPO-CQSZACIVSA-N 1 1 328.865 4.356 20 5 EIBDMO CC(C)O[C@H](C[N@@H+](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000428967245 1044919003 /nfs/dbraw/zinc/91/90/03/1044919003.db2.gz MBUJIKYTQFIKJF-HXUWFJFHSA-N 1 1 342.439 4.235 20 5 EIBDMO CC(C)C[C@H]1CCCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000466670835 1044956558 /nfs/dbraw/zinc/95/65/58/1044956558.db2.gz KAVFPBJGLPSFQB-OAHLLOKOSA-N 1 1 344.415 4.045 20 5 EIBDMO O=[N+]([O-])c1cc(F)c(C[NH2+]C2(c3ccccc3)CCCC2)c(F)c1 ZINC000509036484 1044983683 /nfs/dbraw/zinc/98/36/83/1044983683.db2.gz YTZWPIPYVWZFRC-UHFFFAOYSA-N 1 1 332.350 4.432 20 5 EIBDMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](C1c3ccccc3-c3ccccc31)CC2 ZINC000495454326 1045133239 /nfs/dbraw/zinc/13/32/39/1045133239.db2.gz IUEYQSWKWJNOJN-UHFFFAOYSA-N 1 1 343.386 4.118 20 5 EIBDMO O=[N+]([O-])c1cnc2c(c1)C[N@@H+](C1c3ccccc3-c3ccccc31)CC2 ZINC000495454326 1045133249 /nfs/dbraw/zinc/13/32/49/1045133249.db2.gz IUEYQSWKWJNOJN-UHFFFAOYSA-N 1 1 343.386 4.118 20 5 EIBDMO Cc1ccc(CNc2ccc([N+](=O)[O-])cc2Cl)c(N2CCCC2)[nH+]1 ZINC000302067709 1045158683 /nfs/dbraw/zinc/15/86/83/1045158683.db2.gz WTVPOBNGCHSLPM-UHFFFAOYSA-N 1 1 346.818 4.164 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+]Cc2ccc(Br)cc2[N+](=O)[O-])o1 ZINC000162140227 1045219978 /nfs/dbraw/zinc/21/99/78/1045219978.db2.gz MPXXWZISKJOFAF-JTQLQIEISA-N 1 1 339.189 4.110 20 5 EIBDMO CC(C)c1ccc([C@@H]2CCCC[N@@H+]2Cc2c([N+](=O)[O-])ncn2C)cc1 ZINC000611210802 1045261576 /nfs/dbraw/zinc/26/15/76/1045261576.db2.gz VJPYSKGUVRHTRQ-KRWDZBQOSA-N 1 1 342.443 4.179 20 5 EIBDMO CC(C)c1ccc([C@@H]2CCCC[N@H+]2Cc2c([N+](=O)[O-])ncn2C)cc1 ZINC000611210802 1045261581 /nfs/dbraw/zinc/26/15/81/1045261581.db2.gz VJPYSKGUVRHTRQ-KRWDZBQOSA-N 1 1 342.443 4.179 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@@H]1CCOc2ccccc21)C1CC1 ZINC000611254796 1045267098 /nfs/dbraw/zinc/26/70/98/1045267098.db2.gz MHULKYBJOPZFMN-HNNXBMFYSA-N 1 1 338.407 4.126 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000611517045 1045320520 /nfs/dbraw/zinc/32/05/20/1045320520.db2.gz KYRSCGUKCBMUPN-BBWFWOEESA-N 1 1 332.444 4.103 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000611517050 1045321393 /nfs/dbraw/zinc/32/13/93/1045321393.db2.gz KYRSCGUKCBMUPN-YESZJQIVSA-N 1 1 332.444 4.103 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cccc3cccnc32)C2CC2)c1 ZINC000153301249 1045486906 /nfs/dbraw/zinc/48/69/06/1045486906.db2.gz AJPUWOJSGLLOAO-UHFFFAOYSA-N 1 1 333.391 4.308 20 5 EIBDMO CCC1CCC([N@@H+](CCO)Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC001169971954 1045616269 /nfs/dbraw/zinc/61/62/69/1045616269.db2.gz YCYWVTNFEAKZEY-UHFFFAOYSA-N 1 1 340.851 4.011 20 5 EIBDMO CC[C@@H]([NH2+]Cc1nc(-c2ccccc2)c[nH]1)c1cccc([N+](=O)[O-])c1 ZINC000194354865 1045724807 /nfs/dbraw/zinc/72/48/07/1045724807.db2.gz WVUJZKDRWZVJQO-QGZVFWFLSA-N 1 1 336.395 4.226 20 5 EIBDMO Cc1c(C[NH2+]Cc2nc(-c3ccccc3)cs2)cccc1[N+](=O)[O-] ZINC000326349280 1045794579 /nfs/dbraw/zinc/79/45/79/1045794579.db2.gz CRNWXVPDURDWSB-UHFFFAOYSA-N 1 1 339.420 4.317 20 5 EIBDMO COc1ccc(C[N@H+]2CC=C(c3ccc(C)cc3)CC2)cc1[N+](=O)[O-] ZINC000916994655 1046546370 /nfs/dbraw/zinc/54/63/70/1046546370.db2.gz BCMDOCDJQPFAJI-UHFFFAOYSA-N 1 1 338.407 4.201 20 5 EIBDMO COc1ccc(C[N@@H+]2CC=C(c3ccc(C)cc3)CC2)cc1[N+](=O)[O-] ZINC000916994655 1046546385 /nfs/dbraw/zinc/54/63/85/1046546385.db2.gz BCMDOCDJQPFAJI-UHFFFAOYSA-N 1 1 338.407 4.201 20 5 EIBDMO CC(C)c1ncc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)s1 ZINC000154253840 1046566973 /nfs/dbraw/zinc/56/69/73/1046566973.db2.gz DXQIMEMMZTVKPI-UHFFFAOYSA-N 1 1 331.441 4.339 20 5 EIBDMO CC(C)c1ncc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)s1 ZINC000154253840 1046566986 /nfs/dbraw/zinc/56/69/86/1046566986.db2.gz DXQIMEMMZTVKPI-UHFFFAOYSA-N 1 1 331.441 4.339 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCS[C@@H]2CCCC[C@@H]21 ZINC000752361384 1046625958 /nfs/dbraw/zinc/62/59/58/1046625958.db2.gz XBVKIOVFJWGBDE-LSDHHAIUSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCS[C@@H]2CCCC[C@@H]21 ZINC000752361384 1046625972 /nfs/dbraw/zinc/62/59/72/1046625972.db2.gz XBVKIOVFJWGBDE-LSDHHAIUSA-N 1 1 326.849 4.108 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)c1nc2c(s1)CCC2 ZINC000459634167 1046825615 /nfs/dbraw/zinc/82/56/15/1046825615.db2.gz QINNALXVZFCDLO-VXGBXAGGSA-N 1 1 331.441 4.260 20 5 EIBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)cc1 ZINC000746667603 1046981786 /nfs/dbraw/zinc/98/17/86/1046981786.db2.gz ZBTICPFOSPMGEO-CQSZACIVSA-N 1 1 346.814 4.246 20 5 EIBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000746672705 1046987384 /nfs/dbraw/zinc/98/73/84/1046987384.db2.gz HFDJHDXENSISPR-UONOGXRCSA-N 1 1 328.865 4.354 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H]1c1cc(C)on1 ZINC000787405952 1047007259 /nfs/dbraw/zinc/00/72/59/1047007259.db2.gz IVSAYAPLSPULEE-YVJSUPCUSA-N 1 1 327.384 4.132 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H]1c1cc(C)on1 ZINC000787405952 1047007275 /nfs/dbraw/zinc/00/72/75/1047007275.db2.gz IVSAYAPLSPULEE-YVJSUPCUSA-N 1 1 327.384 4.132 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCc2cccc(F)c2)C2CC2)cc1F ZINC000788481105 1047199140 /nfs/dbraw/zinc/19/91/40/1047199140.db2.gz QGWPCBOWGMJJNO-UHFFFAOYSA-N 1 1 332.350 4.080 20 5 EIBDMO C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788481039 1047199459 /nfs/dbraw/zinc/19/94/59/1047199459.db2.gz OZRFBGAUOQMYPC-IUODEOHRSA-N 1 1 332.350 4.251 20 5 EIBDMO CC[C@H](c1cccc(OC)c1)[N@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000808761273 1048087155 /nfs/dbraw/zinc/08/71/55/1048087155.db2.gz KNNVIJLUBPJJLT-QGZVFWFLSA-N 1 1 332.375 4.326 20 5 EIBDMO CC[C@H](c1cccc(OC)c1)[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000808761273 1048087172 /nfs/dbraw/zinc/08/71/72/1048087172.db2.gz KNNVIJLUBPJJLT-QGZVFWFLSA-N 1 1 332.375 4.326 20 5 EIBDMO Cc1cc(Cl)cc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000815130225 1048330043 /nfs/dbraw/zinc/33/00/43/1048330043.db2.gz XOWMLTKXORVKHI-UHFFFAOYSA-N 1 1 325.195 4.500 20 5 EIBDMO CC(C)C[C@@H]1CCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000557030341 1048407926 /nfs/dbraw/zinc/40/79/26/1048407926.db2.gz LUVOTZGBPLILRJ-INIZCTEOSA-N 1 1 343.427 4.303 20 5 EIBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@@H+]1CC[C@@H](c2ccco2)C1 ZINC000809946729 1048571996 /nfs/dbraw/zinc/57/19/96/1048571996.db2.gz KUGVWCRTQMHDME-SNVBAGLBSA-N 1 1 341.194 4.484 20 5 EIBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000809946729 1048572009 /nfs/dbraw/zinc/57/20/09/1048572009.db2.gz KUGVWCRTQMHDME-SNVBAGLBSA-N 1 1 341.194 4.484 20 5 EIBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+](CCO)C1CCCCC1 ZINC000809965577 1048573828 /nfs/dbraw/zinc/57/38/28/1048573828.db2.gz LNCUPWMMJMQZEN-UHFFFAOYSA-N 1 1 347.242 4.029 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3cnc(Cl)c(F)c3)C2)cc1 ZINC000846959364 1048964161 /nfs/dbraw/zinc/96/41/61/1048964161.db2.gz PKKHLAPZCORTKG-AWEZNQCLSA-N 1 1 349.793 4.162 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cnc(Cl)c(F)c3)C2)cc1 ZINC000846959364 1048964169 /nfs/dbraw/zinc/96/41/69/1048964169.db2.gz PKKHLAPZCORTKG-AWEZNQCLSA-N 1 1 349.793 4.162 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cnc(Cl)c(F)c3)C2)cc1 ZINC000846959367 1048964768 /nfs/dbraw/zinc/96/47/68/1048964768.db2.gz PKKHLAPZCORTKG-CQSZACIVSA-N 1 1 349.793 4.162 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cnc(Cl)c(F)c3)C2)cc1 ZINC000846959367 1048964781 /nfs/dbraw/zinc/96/47/81/1048964781.db2.gz PKKHLAPZCORTKG-CQSZACIVSA-N 1 1 349.793 4.162 20 5 EIBDMO COc1ccc(C[N@H+]2[C@H](C)C[C@H](c3ccccc3)[C@H]2C)cc1[N+](=O)[O-] ZINC001170638493 1049181159 /nfs/dbraw/zinc/18/11/59/1049181159.db2.gz JGHMKQBZRJTALB-RKVPGOIHSA-N 1 1 340.423 4.370 20 5 EIBDMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000609706149 1049279912 /nfs/dbraw/zinc/27/99/12/1049279912.db2.gz GRPOYJPVBGLUMQ-INIZCTEOSA-N 1 1 348.443 4.110 20 5 EIBDMO O=[N+]([O-])c1cc(F)ccc1NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000064550894 1049336813 /nfs/dbraw/zinc/33/68/13/1049336813.db2.gz HFYIMFSLIGWJPT-CYBMUJFWSA-N 1 1 349.431 4.120 20 5 EIBDMO C[C@H]1SCC[N@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000609829402 1049348353 /nfs/dbraw/zinc/34/83/53/1049348353.db2.gz AJNGFQRIJVFFNB-KDOFPFPSSA-N 1 1 328.437 4.273 20 5 EIBDMO C[C@H]1SCC[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000609829402 1049348370 /nfs/dbraw/zinc/34/83/70/1049348370.db2.gz AJNGFQRIJVFFNB-KDOFPFPSSA-N 1 1 328.437 4.273 20 5 EIBDMO C[C@H](Cc1ccc(Cl)cc1)[N@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000609915500 1049395070 /nfs/dbraw/zinc/39/50/70/1049395070.db2.gz BJAFZKNFTXQQJK-GFCCVEGCSA-N 1 1 336.794 4.450 20 5 EIBDMO C[C@H](Cc1ccc(Cl)cc1)[N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000609915500 1049395089 /nfs/dbraw/zinc/39/50/89/1049395089.db2.gz BJAFZKNFTXQQJK-GFCCVEGCSA-N 1 1 336.794 4.450 20 5 EIBDMO COc1ccc(C[N@H+]2C[C@@H](c3ccccc3C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000610001848 1049469685 /nfs/dbraw/zinc/46/96/85/1049469685.db2.gz FSVAOAYWJIJSCN-RDJZCZTQSA-N 1 1 340.423 4.290 20 5 EIBDMO CC(C)[N@@H+](C)Cc1ccccc1CNc1ncc([N+](=O)[O-])cc1Cl ZINC000301249214 1049559339 /nfs/dbraw/zinc/55/93/39/1049559339.db2.gz ANZHEVJNHINARA-UHFFFAOYSA-N 1 1 348.834 4.096 20 5 EIBDMO CC[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])[C@H](C)[C@@H](O)c1ccccc1 ZINC000812849301 1049610311 /nfs/dbraw/zinc/61/03/11/1049610311.db2.gz NHJVYLGTGWDZDL-FZKQIMNGSA-N 1 1 348.830 4.192 20 5 EIBDMO C[N@@H+](Cc1ccccc1F)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172917639 1050233342 /nfs/dbraw/zinc/23/33/42/1050233342.db2.gz WGWLJYONWBYSSK-QGZVFWFLSA-N 1 1 328.387 4.113 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCc3cc(F)ccc3C1)CC2 ZINC001172919139 1050233596 /nfs/dbraw/zinc/23/35/96/1050233596.db2.gz DZVNQLNEECDRSC-LJQANCHMSA-N 1 1 340.398 4.040 20 5 EIBDMO C[C@@H]1CC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCC1(F)F ZINC001172909692 1050246618 /nfs/dbraw/zinc/24/66/18/1050246618.db2.gz UXVIGGXOISIIPS-CJNGLKHVSA-N 1 1 338.398 4.209 20 5 EIBDMO CN(Cc1c2ccccc2cc2ccccc21)C(=O)[C@H]1CCC[N@@H+](C)C1 ZINC001186355221 1050295905 /nfs/dbraw/zinc/29/59/05/1050295905.db2.gz XLEBSBHVSSKJKP-IBGZPJMESA-N 1 1 346.474 4.293 20 5 EIBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)Cc2ccccc2C)c1F ZINC001173189916 1050337013 /nfs/dbraw/zinc/33/70/13/1050337013.db2.gz OSXLZZYMLQXTKZ-CQSZACIVSA-N 1 1 346.402 4.114 20 5 EIBDMO CCC[N@@H+]([C@H](C)CC)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173184195 1050337637 /nfs/dbraw/zinc/33/76/37/1050337637.db2.gz LWMPVTJAJRFYLD-CHWSQXEVSA-N 1 1 326.412 4.184 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C12CC3CC(CC(C3)C1)C2 ZINC001173226001 1050357462 /nfs/dbraw/zinc/35/74/62/1050357462.db2.gz GXBTZVZKMONODI-UYIIGHAYSA-N 1 1 328.456 4.426 20 5 EIBDMO Cc1cc([N+](=O)[O-])cnc1S[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001186757192 1050406891 /nfs/dbraw/zinc/40/68/91/1050406891.db2.gz NQUMOASKQQSFKO-QGZVFWFLSA-N 1 1 343.452 4.055 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@H]1COc3c1cccc3Cl)CCC2 ZINC000618572020 1050412612 /nfs/dbraw/zinc/41/26/12/1050412612.db2.gz IJVSWVOZXSNTBN-IRXDYDNUSA-N 1 1 344.798 4.349 20 5 EIBDMO O=[N+]([O-])c1cccc(Br)c1C[NH2+]C/C=C/c1ccccc1 ZINC001178322626 1050444697 /nfs/dbraw/zinc/44/46/97/1050444697.db2.gz YTUXLPKDQLYUPZ-VMPITWQZSA-N 1 1 347.212 4.160 20 5 EIBDMO O=[N+]([O-])c1cccc(Br)c1C[NH2+]C/C=C\c1ccccc1 ZINC001178322628 1050444945 /nfs/dbraw/zinc/44/49/45/1050444945.db2.gz YTUXLPKDQLYUPZ-YVMONPNESA-N 1 1 347.212 4.160 20 5 EIBDMO C[C@@H]1[C@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)CN1c1ccccc1[N+](=O)[O-] ZINC001186906718 1050446544 /nfs/dbraw/zinc/44/65/44/1050446544.db2.gz VTAFWAZYUPOADS-YESZJQIVSA-N 1 1 339.439 4.083 20 5 EIBDMO Nc1c2cccnc2c2ncccc2c1Nc1cc[nH+]c2ccccc12 ZINC001174040114 1050717195 /nfs/dbraw/zinc/71/71/95/1050717195.db2.gz SJKYPPGQKPDPFF-UHFFFAOYSA-N 1 1 337.386 4.079 20 5 EIBDMO C[C@@H]([N@@H+](C)Cc1cc(Br)c([N+](=O)[O-])s1)C1(C)CC1 ZINC001179973669 1050838023 /nfs/dbraw/zinc/83/80/23/1050838023.db2.gz FCQWUWZNPYSIJB-MRVPVSSYSA-N 1 1 333.251 4.039 20 5 EIBDMO COc1ccccc1C[C@H](C)[N@@H+](C)Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001180183343 1050895387 /nfs/dbraw/zinc/89/53/87/1050895387.db2.gz BVQMWOYROOLHNU-HNNXBMFYSA-N 1 1 342.439 4.283 20 5 EIBDMO CC[C@H]1C[C@@H](C)C[N@@H+]1Cc1cc(Br)c([N+](=O)[O-])s1 ZINC001180199375 1050927267 /nfs/dbraw/zinc/92/72/67/1050927267.db2.gz RJXWIEWJHRJXPL-BDAKNGLRSA-N 1 1 333.251 4.039 20 5 EIBDMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1cc(Br)c([N+](=O)[O-])s1 ZINC001180199375 1050927277 /nfs/dbraw/zinc/92/72/77/1050927277.db2.gz RJXWIEWJHRJXPL-BDAKNGLRSA-N 1 1 333.251 4.039 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1cc3c(cccc3O)s1)CC2 ZINC001180267624 1050942228 /nfs/dbraw/zinc/94/22/28/1050942228.db2.gz ZJNLTYFQLOIFCA-UHFFFAOYSA-N 1 1 340.404 4.073 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](Cc1cc3c(cccc3O)s1)CC2 ZINC001180267624 1050942239 /nfs/dbraw/zinc/94/22/39/1050942239.db2.gz ZJNLTYFQLOIFCA-UHFFFAOYSA-N 1 1 340.404 4.073 20 5 EIBDMO CCC[N@@H+](Cc1cc([O-])ccc1[N+](=O)[O-])[C@H]1CCc2ccccc21 ZINC001190570777 1051218173 /nfs/dbraw/zinc/21/81/73/1051218173.db2.gz JMOHZHHTMRPXJC-IBGZPJMESA-N 1 1 326.396 4.200 20 5 EIBDMO COc1ccc(C2([NH2+]Cc3cc(Cl)ccc3[N+](=O)[O-])CC2)cc1 ZINC000775411421 1051277046 /nfs/dbraw/zinc/27/70/46/1051277046.db2.gz PLWSDJKDCWTIEU-UHFFFAOYSA-N 1 1 332.787 4.036 20 5 EIBDMO CC[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@@H](C)Cc1ccc(OC)cc1 ZINC001190985104 1051317888 /nfs/dbraw/zinc/31/78/88/1051317888.db2.gz MYNCXALBIDORAQ-AWEZNQCLSA-N 1 1 346.402 4.196 20 5 EIBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC001191338624 1051423763 /nfs/dbraw/zinc/42/37/63/1051423763.db2.gz APHKVNPZFUQOGG-CYBMUJFWSA-N 1 1 348.830 4.320 20 5 EIBDMO COc1ccc(C[N@H+]2CC[C@@H](Cc3ccccc3)[C@H]2C)cc1[N+](=O)[O-] ZINC001191475993 1051462528 /nfs/dbraw/zinc/46/25/28/1051462528.db2.gz QQDOYBCCPOXBEH-QAPCUYQASA-N 1 1 340.423 4.057 20 5 EIBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC001191646401 1051508240 /nfs/dbraw/zinc/50/82/40/1051508240.db2.gz LWZIHDPNAUXWTE-GOSISDBHSA-N 1 1 326.371 4.386 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](OC2CCC2)C1 ZINC001182633988 1051654444 /nfs/dbraw/zinc/65/44/44/1051654444.db2.gz HGBBIQFLFMVFJR-LSSBLYJVSA-N 1 1 330.428 4.032 20 5 EIBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C(C)(C)c1ccccc1 ZINC001182756110 1051686002 /nfs/dbraw/zinc/68/60/02/1051686002.db2.gz WIJVZZVFNOATCP-UHFFFAOYSA-N 1 1 325.368 4.103 20 5 EIBDMO CC[C@@]1(CCc2ccccc2)CCC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC001175757332 1051771271 /nfs/dbraw/zinc/77/12/71/1051771271.db2.gz AZNVTBNPPQJZBM-FQEVSTJZSA-N 1 1 339.439 4.367 20 5 EIBDMO CCOc1cc(C[N@@H+](C)CCCc2ccccc2)ccc1[N+](=O)[O-] ZINC001193032590 1051856852 /nfs/dbraw/zinc/85/68/52/1051856852.db2.gz FHARYDZDTGIMOD-UHFFFAOYSA-N 1 1 328.412 4.058 20 5 EIBDMO CCC1(CC)CCC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC001193430638 1051926843 /nfs/dbraw/zinc/92/68/43/1051926843.db2.gz NPTHQLNZQSOSEW-UHFFFAOYSA-N 1 1 347.459 4.134 20 5 EIBDMO Cc1ccc([C@@H]2C[C@@H](C)[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)cc1 ZINC001193932528 1052024950 /nfs/dbraw/zinc/02/49/50/1052024950.db2.gz PSXUOMQHMSMSTI-RHSMWYFYSA-N 1 1 328.387 4.420 20 5 EIBDMO C[C@@H](c1ccccc1)[C@@H]1CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001176356844 1052035575 /nfs/dbraw/zinc/03/55/75/1052035575.db2.gz VZAVBHJNEUGKGI-JXFKEZNVSA-N 1 1 340.423 4.242 20 5 EIBDMO Cc1ccnc(Nc2ccc([NH+]3CCCCCC3)cc2)c1[N+](=O)[O-] ZINC001184644600 1052068597 /nfs/dbraw/zinc/06/85/97/1052068597.db2.gz RFYIWHRTLXFDME-UHFFFAOYSA-N 1 1 326.400 4.422 20 5 EIBDMO CCC1CCC([N@@H+](CCO)Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC001194067027 1052068883 /nfs/dbraw/zinc/06/88/83/1052068883.db2.gz VFSXQTDJEKGYNO-UHFFFAOYSA-N 1 1 340.851 4.011 20 5 EIBDMO CC[C@H](c1cccc(OC)c1)[N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC001194106804 1052073756 /nfs/dbraw/zinc/07/37/56/1052073756.db2.gz BPJITKVDMUHTOU-GOSISDBHSA-N 1 1 328.412 4.495 20 5 EIBDMO Cc1cc(Nc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)ncc1[N+](=O)[O-] ZINC001184884473 1052116367 /nfs/dbraw/zinc/11/63/67/1052116367.db2.gz AREDXGICCUPFSH-OAHLLOKOSA-N 1 1 340.427 4.416 20 5 EIBDMO C[N@H+](C/C=C/c1ccc(Cl)cc1)CCc1ccccc1[N+](=O)[O-] ZINC001194263281 1052121701 /nfs/dbraw/zinc/12/17/01/1052121701.db2.gz WOCCTZUZSOGYKB-SNAWJCMRSA-N 1 1 330.815 4.436 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CCCc3ccsc3)C2)cc1 ZINC001194478749 1052158863 /nfs/dbraw/zinc/15/88/63/1052158863.db2.gz XZWCTGVDKUKEKW-QGZVFWFLSA-N 1 1 330.453 4.469 20 5 EIBDMO CC(C)[C@@H](c1ccccc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774889342 1052250368 /nfs/dbraw/zinc/25/03/68/1052250368.db2.gz ZEQKZKVXFGTTBD-SFHVURJKSA-N 1 1 343.383 4.332 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccn(C3CCCC3)n1)CCC2 ZINC000193031905 1053021989 /nfs/dbraw/zinc/02/19/89/1053021989.db2.gz XSFHYBTWHZRVJU-IBGZPJMESA-N 1 1 340.427 4.074 20 5 EIBDMO CC[N@@H+](C[C@H](O)c1ccc(C)cc1)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000764285652 1053052113 /nfs/dbraw/zinc/05/21/13/1053052113.db2.gz YJKOQLKNTFYXJV-BEFAXECRSA-N 1 1 328.412 4.020 20 5 EIBDMO CC[N@@H+](C[C@@H](O)c1ccc(C)cc1)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000764282159 1053052234 /nfs/dbraw/zinc/05/22/34/1053052234.db2.gz CIPIAKCNYJMWRM-HNAYVOBHSA-N 1 1 328.412 4.020 20 5 EIBDMO C[N@H+](Cc1csc([N+](=O)[O-])c1)[C@H]1C[C@H](Oc2ccccc2)C1(C)C ZINC001194881564 1053138582 /nfs/dbraw/zinc/13/85/82/1053138582.db2.gz ALVIRISBXTUKQK-HOTGVXAUSA-N 1 1 346.452 4.334 20 5 EIBDMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@H]1C[C@H](Oc2ccccc2)C1(C)C ZINC001194881564 1053138615 /nfs/dbraw/zinc/13/86/15/1053138615.db2.gz ALVIRISBXTUKQK-HOTGVXAUSA-N 1 1 346.452 4.334 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC000864037891 1053181370 /nfs/dbraw/zinc/18/13/70/1053181370.db2.gz CHFWETIFAXHURN-KRWDZBQOSA-N 1 1 345.830 4.325 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC000864037891 1053181400 /nfs/dbraw/zinc/18/14/00/1053181400.db2.gz CHFWETIFAXHURN-KRWDZBQOSA-N 1 1 345.830 4.325 20 5 EIBDMO C[C@@H](CSc1ccccc1)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC001195850771 1053494165 /nfs/dbraw/zinc/49/41/65/1053494165.db2.gz DFNFVDWDYDWHFZ-HNNXBMFYSA-N 1 1 346.452 4.086 20 5 EIBDMO CC(C)c1ccc(C[NH2+]Cc2noc3ccc(F)cc23)cc1[N+](=O)[O-] ZINC000865761330 1053588164 /nfs/dbraw/zinc/58/81/64/1053588164.db2.gz UTNPLGNBBMQYSS-UHFFFAOYSA-N 1 1 343.358 4.288 20 5 EIBDMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001196330072 1053640372 /nfs/dbraw/zinc/64/03/72/1053640372.db2.gz SPVXECBLAMKYPT-XJKSGUPXSA-N 1 1 329.400 4.403 20 5 EIBDMO COC[C@H](C)[N@H+](Cc1csc([N+](=O)[O-])c1)[C@H]1CCc2ccccc21 ZINC001196646028 1053710139 /nfs/dbraw/zinc/71/01/39/1053710139.db2.gz FKNNJLXVDOKOEM-GUYCJALGSA-N 1 1 346.452 4.181 20 5 EIBDMO COC[C@H](C)[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@H]1CCc2ccccc21 ZINC001196646028 1053710150 /nfs/dbraw/zinc/71/01/50/1053710150.db2.gz FKNNJLXVDOKOEM-GUYCJALGSA-N 1 1 346.452 4.181 20 5 EIBDMO C[C@@H](C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC001196819787 1053780351 /nfs/dbraw/zinc/78/03/51/1053780351.db2.gz WCELYEWROKMSHL-HNNXBMFYSA-N 1 1 347.459 4.072 20 5 EIBDMO C[C@H](C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC001196819788 1053781218 /nfs/dbraw/zinc/78/12/18/1053781218.db2.gz WCELYEWROKMSHL-OAHLLOKOSA-N 1 1 347.459 4.072 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccc([N+](=O)[O-])cc1 ZINC001197646777 1053958928 /nfs/dbraw/zinc/95/89/28/1053958928.db2.gz JYNMADWHNKKIMJ-SNVBAGLBSA-N 1 1 335.747 4.007 20 5 EIBDMO C[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC001197660394 1053960459 /nfs/dbraw/zinc/96/04/59/1053960459.db2.gz NPUSXRYMCGQCGJ-SCLBCKFNSA-N 1 1 341.367 4.086 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1C[C@H]2C[C@@]2(c2ccccc2)C1 ZINC001197718673 1053971910 /nfs/dbraw/zinc/97/19/10/1053971910.db2.gz AFXUYHFZEOSRJC-QAPCUYQASA-N 1 1 328.799 4.022 20 5 EIBDMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1ccc([N+](=O)[O-])cc1Br ZINC001168570333 1054116971 /nfs/dbraw/zinc/11/69/71/1054116971.db2.gz MWWXAUHFUPBMIS-ZYHUDNBSSA-N 1 1 327.222 4.120 20 5 EIBDMO Cc1nc2c(s1)[C@H]([NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])CCC2 ZINC000872060197 1054369674 /nfs/dbraw/zinc/36/96/74/1054369674.db2.gz NUZZAHYVFZYDQQ-BXKDBHETSA-N 1 1 335.404 4.227 20 5 EIBDMO CCC(CC)c1cc(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)on1 ZINC000873062511 1054482887 /nfs/dbraw/zinc/48/28/87/1054482887.db2.gz SBNZFVVVMYTPNA-UHFFFAOYSA-N 1 1 331.416 4.393 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H]2c2ccccc2Cl)cc1 ZINC000776278259 1055150225 /nfs/dbraw/zinc/15/02/25/1055150225.db2.gz SRINXRXKZPNFEH-QZTJIDSGSA-N 1 1 346.814 4.119 20 5 EIBDMO C[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CCCCCCC1 ZINC000878019799 1055176467 /nfs/dbraw/zinc/17/64/67/1055176467.db2.gz GWWTYZMXBOPKAY-UHFFFAOYSA-N 1 1 344.415 4.190 20 5 EIBDMO CCC[C@@H](C)[C@@H]1CCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878199476 1055203896 /nfs/dbraw/zinc/20/38/96/1055203896.db2.gz AZFIDPDXQGZACE-HIFRSBDPSA-N 1 1 344.415 4.045 20 5 EIBDMO Cc1c([C@H](C)[NH2+][C@H]2CCCc3cn(C(C)C)nc32)cccc1[N+](=O)[O-] ZINC000765819039 1055558267 /nfs/dbraw/zinc/55/82/67/1055558267.db2.gz PZSGXHLNCWVHHI-YOEHRIQHSA-N 1 1 342.443 4.409 20 5 EIBDMO CC(C)n1cc2c(n1)[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)CCC2 ZINC000765818786 1055567588 /nfs/dbraw/zinc/56/75/88/1055567588.db2.gz OOMJEIFVDLYEHG-SUMWQHHRSA-N 1 1 328.416 4.100 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1cccc(Cl)c1Cl ZINC000542699935 1055842475 /nfs/dbraw/zinc/84/24/75/1055842475.db2.gz OAIVEYRFTYHJPA-UHFFFAOYSA-N 1 1 325.195 4.500 20 5 EIBDMO Cc1nc(C(F)(F)F)c(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000273600621 1055989511 /nfs/dbraw/zinc/98/95/11/1055989511.db2.gz LFZPTGFDDCTHRP-MRVPVSSYSA-N 1 1 345.346 4.229 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1c2ccc(F)cc2O[C@@H]1C ZINC000554090297 1056009412 /nfs/dbraw/zinc/00/94/12/1056009412.db2.gz PRCLUTSHRCXFJC-IUUKEHGRSA-N 1 1 330.359 4.215 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CC=C(c3c[nH]c4ccccc34)CC2)c1 ZINC000542816189 1056097040 /nfs/dbraw/zinc/09/70/40/1056097040.db2.gz QRYFCLICTLDJAB-UHFFFAOYSA-N 1 1 333.391 4.365 20 5 EIBDMO C[C@H]1C[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC[C@@H]1c1ccccc1 ZINC000741807681 1058376427 /nfs/dbraw/zinc/37/64/27/1058376427.db2.gz JZUGMDZKUYONBQ-KSSFIOAISA-N 1 1 328.387 4.360 20 5 EIBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H](O)c1cccc(Cl)c1 ZINC000743263257 1058905533 /nfs/dbraw/zinc/90/55/33/1058905533.db2.gz AHBWKJNKGKRYGK-SFHVURJKSA-N 1 1 348.830 4.192 20 5 EIBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000743869608 1059180852 /nfs/dbraw/zinc/18/08/52/1059180852.db2.gz SKFQPYOPDHNFNX-GXTWGEPZSA-N 1 1 328.865 4.354 20 5 EIBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000743869611 1059181359 /nfs/dbraw/zinc/18/13/59/1059181359.db2.gz SKFQPYOPDHNFNX-TZMCWYRMSA-N 1 1 328.865 4.354 20 5 EIBDMO Cc1ccc(-c2nc(C[NH2+]C/C=C\c3ccccc3[N+](=O)[O-])co2)cc1 ZINC000744447563 1059517158 /nfs/dbraw/zinc/51/71/58/1059517158.db2.gz RQEILVQXJBTQNX-XQRVVYSFSA-N 1 1 349.390 4.361 20 5 EIBDMO C[N@@H+](Cc1sc2ccccc2c1Cl)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169035784 1060588266 /nfs/dbraw/zinc/58/82/66/1060588266.db2.gz CGKHEORLQIZHLI-NWDGAFQWSA-N 1 1 338.860 4.432 20 5 EIBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@@H](c3cccc(Cl)c3Cl)C2)C1 ZINC001169035906 1060596210 /nfs/dbraw/zinc/59/62/10/1060596210.db2.gz MGMPLSUKMMDXAT-JHJVBQTASA-N 1 1 343.254 4.228 20 5 EIBDMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC001169282479 1060738345 /nfs/dbraw/zinc/73/83/45/1060738345.db2.gz DFOWQIDSPKFLLZ-RISCZKNCSA-N 1 1 341.249 4.368 20 5 EIBDMO C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c3c2CC[N@H+](C)C3)c2ccccc21 ZINC001169379959 1060792932 /nfs/dbraw/zinc/79/29/32/1060792932.db2.gz PAMIRJOYZRZLTE-YJYMSZOUSA-N 1 1 337.423 4.243 20 5 EIBDMO C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c3c2CC[N@@H+](C)C3)c2ccccc21 ZINC001169379959 1060792945 /nfs/dbraw/zinc/79/29/45/1060792945.db2.gz PAMIRJOYZRZLTE-YJYMSZOUSA-N 1 1 337.423 4.243 20 5 EIBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CCC=C(C)C2)cc1OC ZINC001169761286 1060948987 /nfs/dbraw/zinc/94/89/87/1060948987.db2.gz HGRXEBMTYOMWRP-CQSZACIVSA-N 1 1 348.443 4.180 20 5 EIBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CCC=C(C)C2)cc1OC ZINC001169761286 1060949006 /nfs/dbraw/zinc/94/90/06/1060949006.db2.gz HGRXEBMTYOMWRP-CQSZACIVSA-N 1 1 348.443 4.180 20 5 EIBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCCCC[C@H]2c2ccco2)c1 ZINC000078831623 217130044 /nfs/dbraw/zinc/13/00/44/217130044.db2.gz FTFJFMUVJGAHKV-KRWDZBQOSA-N 1 1 330.384 4.184 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000533019992 1032448713 /nfs/dbraw/zinc/44/87/13/1032448713.db2.gz HKCGDLNNDZFLNU-AWEZNQCLSA-N 1 1 348.406 4.321 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+]C1(c2ccc(F)cc2)CC1 ZINC000533068495 1032470977 /nfs/dbraw/zinc/47/09/77/1032470977.db2.gz FABRXSQZSXRICQ-UHFFFAOYSA-N 1 1 344.386 4.300 20 5 EIBDMO C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000475742973 1032555698 /nfs/dbraw/zinc/55/56/98/1032555698.db2.gz VNJIWMRBVHCOEJ-HZSPNIEDSA-N 1 1 329.400 4.116 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1cccc2ccccc21 ZINC001167050336 1018874812 /nfs/dbraw/zinc/87/48/12/1018874812.db2.gz YLQCWVCKHWGJJC-UHFFFAOYSA-N 1 1 336.391 4.389 20 5 EIBDMO CSC[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000430192474 1019108945 /nfs/dbraw/zinc/10/89/45/1019108945.db2.gz ATQIIDKRHQZIRB-CQSZACIVSA-N 1 1 346.452 4.430 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000430196179 1019183590 /nfs/dbraw/zinc/18/35/90/1019183590.db2.gz QHVRGDQXVVAHLE-QGZVFWFLSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000430196179 1019183609 /nfs/dbraw/zinc/18/36/09/1019183609.db2.gz QHVRGDQXVVAHLE-QGZVFWFLSA-N 1 1 330.359 4.080 20 5 EIBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCCC12CCOCC2 ZINC001167186281 1020503165 /nfs/dbraw/zinc/50/31/65/1020503165.db2.gz CUXMRTLRVZORBI-SFHVURJKSA-N 1 1 346.471 4.402 20 5 EIBDMO C[N@H+](Cc1cc2ccccc2o1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083216982 1021554274 /nfs/dbraw/zinc/55/42/74/1021554274.db2.gz OBYNOARXCFGSSV-UHFFFAOYSA-N 1 1 337.335 4.114 20 5 EIBDMO C[N@@H+](Cc1cc2ccccc2o1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083216982 1021554296 /nfs/dbraw/zinc/55/42/96/1021554296.db2.gz OBYNOARXCFGSSV-UHFFFAOYSA-N 1 1 337.335 4.114 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCc2c(F)cccc2F)C2CC2)c1 ZINC001167734190 1022617982 /nfs/dbraw/zinc/61/79/82/1022617982.db2.gz KKHFQUHEYKKCLS-UHFFFAOYSA-N 1 1 332.350 4.080 20 5 EIBDMO Cc1cncc(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)c1 ZINC000181030204 1022881428 /nfs/dbraw/zinc/88/14/28/1022881428.db2.gz PKNPNNREVVOZNX-HXUWFJFHSA-N 1 1 333.391 4.177 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+](Cc3ccco3)C3CCCC3)nc2c1 ZINC000610581207 1023220966 /nfs/dbraw/zinc/22/09/66/1023220966.db2.gz NLGPUUFKEGSHOW-UHFFFAOYSA-N 1 1 341.367 4.274 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+](Cc3ccco3)C3CCCC3)nc2c1 ZINC000610581207 1023220977 /nfs/dbraw/zinc/22/09/77/1023220977.db2.gz NLGPUUFKEGSHOW-UHFFFAOYSA-N 1 1 341.367 4.274 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cccc2cccnc21)C1CC1 ZINC000135237840 1023223437 /nfs/dbraw/zinc/22/34/37/1023223437.db2.gz LDBQJRGFVARHGR-UHFFFAOYSA-N 1 1 333.391 4.308 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC2(CCOCC2)[C@H]1C(C)C ZINC000414523133 1023248618 /nfs/dbraw/zinc/24/86/18/1023248618.db2.gz CVHQFVPASMIICB-JVCXIRSZSA-N 1 1 344.455 4.135 20 5 EIBDMO CCc1nc(C)c(C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)o1 ZINC000417325990 1023266644 /nfs/dbraw/zinc/26/66/44/1023266644.db2.gz CQVPPGXIZXHMFN-INIZCTEOSA-N 1 1 329.400 4.011 20 5 EIBDMO CCOC[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000126566699 1023368532 /nfs/dbraw/zinc/36/85/32/1023368532.db2.gz XOUAYJYQQSBTDS-HNNXBMFYSA-N 1 1 344.411 4.103 20 5 EIBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000051133693 1023467115 /nfs/dbraw/zinc/46/71/15/1023467115.db2.gz CBVIPPNTAUSFOJ-AZUAARDMSA-N 1 1 340.423 4.195 20 5 EIBDMO O=[N+]([O-])c1cccc(C[NH2+]Cc2cc(Cl)ccc2OC(F)F)c1 ZINC000122444732 1023561157 /nfs/dbraw/zinc/56/11/57/1023561157.db2.gz RNSOIDOLPJGMPD-UHFFFAOYSA-N 1 1 342.729 4.139 20 5 EIBDMO CSc1ccc([C@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000500228133 1023605153 /nfs/dbraw/zinc/60/51/53/1023605153.db2.gz BVDPGFTVWQOEBE-NSHDSACASA-N 1 1 343.408 4.309 20 5 EIBDMO C[C@H]1CCCC[N@H+]1CCCNc1cc2cccnc2c2ncccc12 ZINC001167752874 1023627326 /nfs/dbraw/zinc/62/73/26/1023627326.db2.gz IFWLGULVBHPDFQ-INIZCTEOSA-N 1 1 334.467 4.459 20 5 EIBDMO C[C@@H]1CCCC[N@H+]1CCCNc1cc2cccnc2c2ncccc12 ZINC001167752877 1023627528 /nfs/dbraw/zinc/62/75/28/1023627528.db2.gz IFWLGULVBHPDFQ-MRXNPFEDSA-N 1 1 334.467 4.459 20 5 EIBDMO Cc1nn(C(C)C)c(C)c1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000891622578 1023832197 /nfs/dbraw/zinc/83/21/97/1023832197.db2.gz HKGAWVLZQXVFDA-UHFFFAOYSA-N 1 1 342.443 4.154 20 5 EIBDMO Cc1nn(C(C)C)c(C)c1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000891622578 1023832199 /nfs/dbraw/zinc/83/21/99/1023832199.db2.gz HKGAWVLZQXVFDA-UHFFFAOYSA-N 1 1 342.443 4.154 20 5 EIBDMO Cc1ccc([C@@H]2CCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000610580771 1024107882 /nfs/dbraw/zinc/10/78/82/1024107882.db2.gz HHTOOYAZZSTJBB-KRWDZBQOSA-N 1 1 337.379 4.382 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H]3C3CCCCC3)nc2c1 ZINC000610581306 1024116141 /nfs/dbraw/zinc/11/61/41/1024116141.db2.gz WJYYRRGAHNZTIN-INIZCTEOSA-N 1 1 329.400 4.281 20 5 EIBDMO CC[C@H](Cc1ccccc1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610582763 1024168369 /nfs/dbraw/zinc/16/83/69/1024168369.db2.gz WWYWLJZGHJFNRE-OAHLLOKOSA-N 1 1 339.395 4.189 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCO[C@@H]3CCC[C@@H]32)s1 ZINC000510685113 1024231345 /nfs/dbraw/zinc/23/13/45/1024231345.db2.gz UCGRGWOYENGMPK-DLBZAZTESA-N 1 1 344.436 4.077 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCO[C@@H]3CCC[C@@H]32)s1 ZINC000510685113 1024231361 /nfs/dbraw/zinc/23/13/61/1024231361.db2.gz UCGRGWOYENGMPK-DLBZAZTESA-N 1 1 344.436 4.077 20 5 EIBDMO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1cccc([N+](=O)[O-])c1C)CCC2 ZINC000111310847 1024359412 /nfs/dbraw/zinc/35/94/12/1024359412.db2.gz LGGQDADVVSJHED-MRXNPFEDSA-N 1 1 331.441 4.178 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc(Cl)s1 ZINC000047943420 1024371673 /nfs/dbraw/zinc/37/16/73/1024371673.db2.gz PVLYANDNXRJKFX-VIFPVBQESA-N 1 1 326.805 4.169 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCCOc2cc(Cl)ccc21 ZINC000341803517 1024726416 /nfs/dbraw/zinc/72/64/16/1024726416.db2.gz IRFVNMWTWPOGEV-OAHLLOKOSA-N 1 1 332.787 4.252 20 5 EIBDMO CC[C@@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1cccc([N+](=O)[O-])c1 ZINC000610831156 1025052275 /nfs/dbraw/zinc/05/22/75/1025052275.db2.gz DCOSUTXMQOZTAI-HZPDHXFCSA-N 1 1 332.787 4.423 20 5 EIBDMO COc1cc(C)c(C[N@@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000024802636 1025297225 /nfs/dbraw/zinc/29/72/25/1025297225.db2.gz QLRVPXNYTLTYFY-AWEZNQCLSA-N 1 1 344.411 4.113 20 5 EIBDMO Cn1cccc1[C@H]1CCCC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000538725519 1025511327 /nfs/dbraw/zinc/51/13/27/1025511327.db2.gz ZYAXRUDODSWLFB-MBNRZODZSA-N 1 1 325.412 4.174 20 5 EIBDMO COc1ccc([C@H]([NH2+]Cc2c(F)cccc2[N+](=O)[O-])C(C)C)cc1 ZINC000182055157 1026018082 /nfs/dbraw/zinc/01/80/82/1026018082.db2.gz QCWYUMGGABWNGS-GOSISDBHSA-N 1 1 332.375 4.229 20 5 EIBDMO CC[C@@H]([NH2+][C@H](C)c1nc2c(s1)CCC2)c1cccc([N+](=O)[O-])c1 ZINC000135063034 1026541795 /nfs/dbraw/zinc/54/17/95/1026541795.db2.gz IYAAEZJSCIDAFE-BXUZGUMPSA-N 1 1 331.441 4.342 20 5 EIBDMO C[N@@H+](Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000507133468 1026657831 /nfs/dbraw/zinc/65/78/31/1026657831.db2.gz ZAKQKPBOAUHUKN-UHFFFAOYSA-N 1 1 348.406 4.042 20 5 EIBDMO Cc1cccnc1[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000120857228 1026820053 /nfs/dbraw/zinc/82/00/53/1026820053.db2.gz ICNYLWUQMZDXEQ-MRXNPFEDSA-N 1 1 333.819 4.439 20 5 EIBDMO CC[N@H+](Cc1ccc(Cl)cc1)Cc1cc([N+](=O)[O-])ccc1OC ZINC000519908358 1027039821 /nfs/dbraw/zinc/03/98/21/1027039821.db2.gz URVFEFWMQJUENP-UHFFFAOYSA-N 1 1 334.803 4.279 20 5 EIBDMO CC[N@@H+](Cc1ccc(Cl)cc1)Cc1cc([N+](=O)[O-])ccc1OC ZINC000519908358 1027039828 /nfs/dbraw/zinc/03/98/28/1027039828.db2.gz URVFEFWMQJUENP-UHFFFAOYSA-N 1 1 334.803 4.279 20 5 EIBDMO CC[NH+](CC)Cc1ccccc1CN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000120897359 1027421661 /nfs/dbraw/zinc/42/16/61/1027421661.db2.gz NZPIXYVUTGVYMP-INIZCTEOSA-N 1 1 341.455 4.287 20 5 EIBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000441414659 1027537168 /nfs/dbraw/zinc/53/71/68/1027537168.db2.gz KLKOCZBFQMTZAV-CYBMUJFWSA-N 1 1 348.830 4.320 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](CC(=O)OC(C)C)C1 ZINC000184486692 1027722279 /nfs/dbraw/zinc/72/22/79/1027722279.db2.gz YPECZGPFXWWMNA-JKSUJKDBSA-N 1 1 348.443 4.018 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cnc2ccsc2c1 ZINC000178730128 1027775344 /nfs/dbraw/zinc/77/53/44/1027775344.db2.gz QINLBQVSZUPZKO-LLVKDONJSA-N 1 1 343.408 4.064 20 5 EIBDMO Cc1ccc(C[N@H+](C)[C@H]2CC[C@@H](C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000582992422 1027814110 /nfs/dbraw/zinc/81/41/10/1027814110.db2.gz DSUFPRDWRWOUKZ-OKILXGFUSA-N 1 1 330.350 4.456 20 5 EIBDMO Cc1ccc([C@H](C)[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c(C)c1 ZINC000444588040 1027884134 /nfs/dbraw/zinc/88/41/34/1027884134.db2.gz CZAIKBMTJYGWIY-AWEZNQCLSA-N 1 1 338.411 4.281 20 5 EIBDMO Cc1ccc([C@H](C)[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c(C)c1 ZINC000444588040 1027884137 /nfs/dbraw/zinc/88/41/37/1027884137.db2.gz CZAIKBMTJYGWIY-AWEZNQCLSA-N 1 1 338.411 4.281 20 5 EIBDMO CC[C@H]1CCCC[C@H]1[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000444675376 1027955368 /nfs/dbraw/zinc/95/53/68/1027955368.db2.gz LWGOMLJRJCYQEH-XJKSGUPXSA-N 1 1 344.415 4.045 20 5 EIBDMO CC(C)(C)C1=CC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000536342714 1028062988 /nfs/dbraw/zinc/06/29/88/1028062988.db2.gz IUQAEXDUDNITFE-UHFFFAOYSA-N 1 1 341.411 4.428 20 5 EIBDMO CC(C)(C)C1=CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000536342714 1028063006 /nfs/dbraw/zinc/06/30/06/1028063006.db2.gz IUQAEXDUDNITFE-UHFFFAOYSA-N 1 1 341.411 4.428 20 5 EIBDMO C[C@H](c1ccc(OC(F)F)cc1)[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000445259224 1028428912 /nfs/dbraw/zinc/42/89/12/1028428912.db2.gz JYZZPXCEVVYAOI-GFCCVEGCSA-N 1 1 348.349 4.316 20 5 EIBDMO C[C@H](c1ccc(OC(F)F)cc1)[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000445259224 1028428919 /nfs/dbraw/zinc/42/89/19/1028428919.db2.gz JYZZPXCEVVYAOI-GFCCVEGCSA-N 1 1 348.349 4.316 20 5 EIBDMO CCc1nccn1[C@@H]1CCC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000245519148 1028867954 /nfs/dbraw/zinc/86/79/54/1028867954.db2.gz IKHWHUBLGMWKLH-NVXWUHKLSA-N 1 1 342.443 4.060 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@H](CSc3ccccc3)C2)c1 ZINC000525267526 1029553812 /nfs/dbraw/zinc/55/38/12/1029553812.db2.gz USRMJNGRVAPZNN-INIZCTEOSA-N 1 1 328.437 4.209 20 5 EIBDMO CC(C)C[C@@H]1CCCCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000525410856 1029623937 /nfs/dbraw/zinc/62/39/37/1029623937.db2.gz MLYNIZQWPVEFCI-KRWDZBQOSA-N 1 1 348.443 4.252 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3ccncc3)C2)c(Cl)c1 ZINC000451006885 1030173188 /nfs/dbraw/zinc/17/31/88/1030173188.db2.gz SOXKPRSDZXQOQG-AWEZNQCLSA-N 1 1 331.803 4.023 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3nc(C4CC4)cs3)C2)cc1 ZINC000451546364 1030562572 /nfs/dbraw/zinc/56/25/72/1030562572.db2.gz JCBFXZKKXPZONN-HNNXBMFYSA-N 1 1 343.452 4.308 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3nc(C4CC4)cs3)C2)cc1 ZINC000451546364 1030562589 /nfs/dbraw/zinc/56/25/89/1030562589.db2.gz JCBFXZKKXPZONN-HNNXBMFYSA-N 1 1 343.452 4.308 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](Cc1ccccn1)C(C)C ZINC000527304342 1030607456 /nfs/dbraw/zinc/60/74/56/1030607456.db2.gz BQLZQPSASQMHJD-LFIBNONCSA-N 1 1 325.412 4.304 20 5 EIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@H](C)CC(C)(C)C1 ZINC000612134822 1031027779 /nfs/dbraw/zinc/02/77/79/1031027779.db2.gz CWRGZEWZOJFCJU-OLZOCXBDSA-N 1 1 344.415 4.074 20 5 EIBDMO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1cc(C)ccc1OC ZINC000179424140 1031061528 /nfs/dbraw/zinc/06/15/28/1031061528.db2.gz VBFAVCUPBHWIAH-KRWDZBQOSA-N 1 1 344.411 4.161 20 5 EIBDMO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001168234567 1031386786 /nfs/dbraw/zinc/38/67/86/1031386786.db2.gz MKRSJDUYFRWZKI-ZIAGYGMSSA-N 1 1 344.386 4.121 20 5 EIBDMO C[C@@H]1c2ccc(F)cc2C[C@H](C)[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001168234566 1031387820 /nfs/dbraw/zinc/38/78/20/1031387820.db2.gz MKRSJDUYFRWZKI-UONOGXRCSA-N 1 1 344.386 4.121 20 5 EIBDMO C[C@H]([NH2+][C@H]1CCc2cc(F)c(F)c(F)c21)c1cccc([N+](=O)[O-])c1 ZINC000449087645 1031448681 /nfs/dbraw/zinc/44/86/81/1031448681.db2.gz GTLASYYPSVKION-XPTSAGLGSA-N 1 1 336.313 4.350 20 5 EIBDMO CC(=O)Nc1cccc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000237500081 1031578410 /nfs/dbraw/zinc/57/84/10/1031578410.db2.gz RPTXRHGIEBFRPL-LLVKDONJSA-N 1 1 347.802 4.057 20 5 EIBDMO COc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2Cl)cc1[N+](=O)[O-] ZINC000449347156 1031643626 /nfs/dbraw/zinc/64/36/26/1031643626.db2.gz FZHVFKVBGWGFIS-JTQLQIEISA-N 1 1 338.766 4.247 20 5 EIBDMO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000449461150 1031779323 /nfs/dbraw/zinc/77/93/23/1031779323.db2.gz OPXPJAARBXVYJX-HRLNJXSSSA-N 1 1 328.334 4.271 20 5 EIBDMO Cc1cc(NC[C@@H]2CC[N@H+](C(C)C)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000573653712 1033420876 /nfs/dbraw/zinc/42/08/76/1033420876.db2.gz UBCQENULPDKFSG-LBPRGKRZSA-N 1 1 345.365 4.064 20 5 EIBDMO CCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCc2cccnc21 ZINC000614215658 1033803824 /nfs/dbraw/zinc/80/38/24/1033803824.db2.gz VHNZASGYNLMSHF-LJQANCHMSA-N 1 1 339.439 4.322 20 5 EIBDMO CCc1nc(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cs1 ZINC000433177450 1033985507 /nfs/dbraw/zinc/98/55/07/1033985507.db2.gz QQYGGSDWXIYQME-OAHLLOKOSA-N 1 1 331.441 4.126 20 5 EIBDMO C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccc(C2CC2)cc1 ZINC000419361796 1034477700 /nfs/dbraw/zinc/47/77/00/1034477700.db2.gz UKQGIPRZAJBWJE-LBPRGKRZSA-N 1 1 337.379 4.464 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH2+][C@H]2CCCOc3cc(Cl)ccc32)cs1 ZINC000345703173 1035284310 /nfs/dbraw/zinc/28/43/10/1035284310.db2.gz HRIVPUUYONGBSY-ZDUSSCGKSA-N 1 1 338.816 4.313 20 5 EIBDMO Cc1c([C@H](C)N[C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000183187919 1035319290 /nfs/dbraw/zinc/31/92/90/1035319290.db2.gz ILJIRWNARKBXSU-YESZJQIVSA-N 1 1 345.487 4.207 20 5 EIBDMO Cc1c([C@H](C)N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000183187919 1035319296 /nfs/dbraw/zinc/31/92/96/1035319296.db2.gz ILJIRWNARKBXSU-YESZJQIVSA-N 1 1 345.487 4.207 20 5 EIBDMO CC[C@@H](N[C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000183195551 1035338238 /nfs/dbraw/zinc/33/82/38/1035338238.db2.gz IGYKZUOQMAWHLY-WRWLIDTKSA-N 1 1 345.487 4.289 20 5 EIBDMO CC[C@@H](N[C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000183195551 1035338242 /nfs/dbraw/zinc/33/82/42/1035338242.db2.gz IGYKZUOQMAWHLY-WRWLIDTKSA-N 1 1 345.487 4.289 20 5 EIBDMO COc1ccc(C)cc1[C@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595005072 1035531758 /nfs/dbraw/zinc/53/17/58/1035531758.db2.gz XAGUVZDNYJWTEV-KBPBESRZSA-N 1 1 344.411 4.332 20 5 EIBDMO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1ccc(F)cc1[N+](=O)[O-])CCC2 ZINC000595375732 1035668640 /nfs/dbraw/zinc/66/86/40/1035668640.db2.gz VHFBPITUSCJMJG-CQSZACIVSA-N 1 1 335.404 4.008 20 5 EIBDMO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-])CCC2 ZINC000595375732 1035668648 /nfs/dbraw/zinc/66/86/48/1035668648.db2.gz VHFBPITUSCJMJG-CQSZACIVSA-N 1 1 335.404 4.008 20 5 EIBDMO COc1cccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1Cl ZINC000595419785 1035677487 /nfs/dbraw/zinc/67/74/87/1035677487.db2.gz KYMLISUYSCUVRO-LBPRGKRZSA-N 1 1 334.803 4.416 20 5 EIBDMO Cc1noc(C[NH2+][C@@H]2CC(C)(C)CCc3ccccc32)c1[N+](=O)[O-] ZINC000595471920 1035686783 /nfs/dbraw/zinc/68/67/83/1035686783.db2.gz GSYRJCBBGLLJFM-OAHLLOKOSA-N 1 1 329.400 4.085 20 5 EIBDMO CC[C@H](C)[N@@H+](C)CCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491050205 1035790555 /nfs/dbraw/zinc/79/05/55/1035790555.db2.gz GZXUAQCZSXGTHL-JXFKEZNVSA-N 1 1 341.455 4.004 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H]([C@H]2CCCCO2)C1 ZINC000595789235 1035792224 /nfs/dbraw/zinc/79/22/24/1035792224.db2.gz PVRVJJQIOOMAKW-FRQCXROJSA-N 1 1 332.444 4.245 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@H]([C@@H]2CCCCO2)C1 ZINC000595788866 1035793045 /nfs/dbraw/zinc/79/30/45/1035793045.db2.gz KGKPTHZTZVDFNS-YOEHRIQHSA-N 1 1 338.835 4.029 20 5 EIBDMO Cc1cc([NH+]2CCCCCC2)ccc1Nc1cc[nH]c(=O)c1[N+](=O)[O-] ZINC000596230352 1035836692 /nfs/dbraw/zinc/83/66/92/1035836692.db2.gz JHIUNQIEDYKTJT-UHFFFAOYSA-N 1 1 342.399 4.128 20 5 EIBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc2ncsc2c1 ZINC000485700628 1036197178 /nfs/dbraw/zinc/19/71/78/1036197178.db2.gz YUQICWFOJKREQT-JTQLQIEISA-N 1 1 331.372 4.194 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1Br ZINC000034996167 1036503747 /nfs/dbraw/zinc/50/37/47/1036503747.db2.gz YFSIEGBZOATJMP-LLVKDONJSA-N 1 1 335.201 4.208 20 5 EIBDMO CC1=Nc2ccccc2C12CC[NH+](Cc1csc([N+](=O)[O-])c1)CC2 ZINC000602862071 1036646983 /nfs/dbraw/zinc/64/69/83/1036646983.db2.gz KHOOCBQVTUOINK-UHFFFAOYSA-N 1 1 341.436 4.296 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cc4cnccc4o3)C2)cc1 ZINC000593632926 1036812031 /nfs/dbraw/zinc/81/20/31/1036812031.db2.gz XTDHPJXRNKFHLK-OAHLLOKOSA-N 1 1 337.379 4.116 20 5 EIBDMO CC[C@H]1c2ccsc2CC[N@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000061191721 1036914753 /nfs/dbraw/zinc/91/47/53/1036914753.db2.gz OIOIFBFLECDQOL-AWEZNQCLSA-N 1 1 332.425 4.174 20 5 EIBDMO CC[C@H]1c2ccsc2CC[N@@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000061191721 1036914773 /nfs/dbraw/zinc/91/47/73/1036914773.db2.gz OIOIFBFLECDQOL-AWEZNQCLSA-N 1 1 332.425 4.174 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3ncccc3Cl)C2)cc1 ZINC000599434329 1037009977 /nfs/dbraw/zinc/00/99/77/1037009977.db2.gz YZEHZBWVTNZPME-AWEZNQCLSA-N 1 1 331.803 4.023 20 5 EIBDMO Cc1c(C[N@@H+](C)Cc2ccc(OC(F)F)cc2)cccc1[N+](=O)[O-] ZINC000603838274 1037020815 /nfs/dbraw/zinc/02/08/15/1037020815.db2.gz WIQBZEPVMDMQDU-UHFFFAOYSA-N 1 1 336.338 4.137 20 5 EIBDMO O=C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000590967182 1037215248 /nfs/dbraw/zinc/21/52/48/1037215248.db2.gz CZLNHLSNDFSFKO-BETUJISGSA-N 1 1 342.420 4.019 20 5 EIBDMO COc1ccccc1C[C@H]1CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000058525466 1037833675 /nfs/dbraw/zinc/83/36/75/1037833675.db2.gz MFDFBZCJPUHFGP-GOSISDBHSA-N 1 1 340.423 4.119 20 5 EIBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])Cc1cc(Cl)cc2cccnc21 ZINC000046599256 1038308556 /nfs/dbraw/zinc/30/85/56/1038308556.db2.gz LUNNDVGNTGGKRX-UHFFFAOYSA-N 1 1 341.798 4.428 20 5 EIBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])Cc1cc(Cl)cc2cccnc21 ZINC000046599256 1038308560 /nfs/dbraw/zinc/30/85/60/1038308560.db2.gz LUNNDVGNTGGKRX-UHFFFAOYSA-N 1 1 341.798 4.428 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC000490056592 1038323134 /nfs/dbraw/zinc/32/31/34/1038323134.db2.gz PXYXSTSUQVJDED-WBVHZDCISA-N 1 1 325.412 4.232 20 5 EIBDMO COc1ccc([C@@H]2CC[N@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000504519953 1038392190 /nfs/dbraw/zinc/39/21/90/1038392190.db2.gz BHJUEKPURFIZGB-RHSMWYFYSA-N 1 1 326.396 4.154 20 5 EIBDMO CCCC[C@H](C)[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000554959977 1038803642 /nfs/dbraw/zinc/80/36/42/1038803642.db2.gz FFYXWNFDZQHBCW-AWEZNQCLSA-N 1 1 331.416 4.303 20 5 EIBDMO COc1ccc([C@@H](C)[NH2+]Cc2c(Cl)cccc2[N+](=O)[O-])cc1F ZINC000119639065 1038983458 /nfs/dbraw/zinc/98/34/58/1038983458.db2.gz SYSVGKBMRABNKA-SNVBAGLBSA-N 1 1 338.766 4.247 20 5 EIBDMO CCOc1ccc(C(C)=O)cc1C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000539328025 1038992511 /nfs/dbraw/zinc/99/25/11/1038992511.db2.gz NJFUAPNBKCCTGY-CYBMUJFWSA-N 1 1 342.395 4.047 20 5 EIBDMO C[C@@H]([NH2+][C@@H](CN(C)C)c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000555226023 1038994007 /nfs/dbraw/zinc/99/40/07/1038994007.db2.gz OPBUFTQMRNSYKT-ACJLOTCBSA-N 1 1 347.846 4.202 20 5 EIBDMO CC(C)C[C@H]1CCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000534113818 1039114920 /nfs/dbraw/zinc/11/49/20/1039114920.db2.gz HTOPHBKLTLPZLO-QGZVFWFLSA-N 1 1 329.400 4.260 20 5 EIBDMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000534108691 1039129422 /nfs/dbraw/zinc/12/94/22/1039129422.db2.gz STTWNPBVIBXMQW-MRXNPFEDSA-N 1 1 329.400 4.260 20 5 EIBDMO Cc1ccccc1C[C@H]1CCC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000514184962 1039704228 /nfs/dbraw/zinc/70/42/28/1039704228.db2.gz AWDBEIYYKCDMJR-MRXNPFEDSA-N 1 1 328.387 4.249 20 5 EIBDMO COc1cccc(F)c1[C@H](C)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192904847 1039850840 /nfs/dbraw/zinc/85/08/40/1039850840.db2.gz SSZUYSZYVGJURR-SJCJKPOMSA-N 1 1 344.386 4.471 20 5 EIBDMO C[N@H+](Cc1cccs1)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159417336 1039972838 /nfs/dbraw/zinc/97/28/38/1039972838.db2.gz BABUBNDUAZTMOY-UHFFFAOYSA-N 1 1 341.230 4.051 20 5 EIBDMO C[N@@H+](Cc1cccs1)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159417336 1039972862 /nfs/dbraw/zinc/97/28/62/1039972862.db2.gz BABUBNDUAZTMOY-UHFFFAOYSA-N 1 1 341.230 4.051 20 5 EIBDMO CCCCN1CCC([NH2+][C@@H](CCC)c2cccc([N+](=O)[O-])c2)CC1 ZINC000325116232 1040059596 /nfs/dbraw/zinc/05/95/96/1040059596.db2.gz NHIPPTVEMRFGHP-IBGZPJMESA-N 1 1 333.476 4.290 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2ccc(OC3CCCC3)cc2)cs1 ZINC000551271227 1040136227 /nfs/dbraw/zinc/13/62/27/1040136227.db2.gz MBNCLRFBWTUBSZ-UHFFFAOYSA-N 1 1 332.425 4.268 20 5 EIBDMO C[C@@H]1CCCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000482295648 1040148232 /nfs/dbraw/zinc/14/82/32/1040148232.db2.gz MINBXTUPZMLHPL-CYBMUJFWSA-N 1 1 331.441 4.340 20 5 EIBDMO C[C@H](N[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000482314543 1040166115 /nfs/dbraw/zinc/16/61/15/1040166115.db2.gz KAZUFHRIVPBCSY-TXPKVOOTSA-N 1 1 339.439 4.081 20 5 EIBDMO C[C@H](N[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000482314543 1040166132 /nfs/dbraw/zinc/16/61/32/1040166132.db2.gz KAZUFHRIVPBCSY-TXPKVOOTSA-N 1 1 339.439 4.081 20 5 EIBDMO CCC[C@@H]([NH2+]Cc1cn2ccc(C)cc2n1)c1cccc([N+](=O)[O-])c1 ZINC000482516984 1040315051 /nfs/dbraw/zinc/31/50/51/1040315051.db2.gz YRFLGLIHVZIDBM-GOSISDBHSA-N 1 1 338.411 4.182 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](Cc1ccccc1)[C@H](C)C1CC1 ZINC000029842251 1040466287 /nfs/dbraw/zinc/46/62/87/1040466287.db2.gz SFOHJYNGADEHGZ-OAHLLOKOSA-N 1 1 340.423 4.404 20 5 EIBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccccc1OC(F)(F)F ZINC000479831579 1040691791 /nfs/dbraw/zinc/69/17/91/1040691791.db2.gz NITJAKGXHRXEPE-UHFFFAOYSA-N 1 1 340.301 4.125 20 5 EIBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccccc1OC(F)(F)F ZINC000479831579 1040691805 /nfs/dbraw/zinc/69/18/05/1040691805.db2.gz NITJAKGXHRXEPE-UHFFFAOYSA-N 1 1 340.301 4.125 20 5 EIBDMO CCOc1ccc([C@@H](C)Nc2ccc3c(c2)[nH+]cn3C)cc1[N+](=O)[O-] ZINC000539737076 1040739938 /nfs/dbraw/zinc/73/99/38/1040739938.db2.gz KQYYZVZWUUJENP-GFCCVEGCSA-N 1 1 340.383 4.053 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCO[C@H](c2ccccc2C)C1 ZINC000539808789 1040804790 /nfs/dbraw/zinc/80/47/90/1040804790.db2.gz XCHKOMKNEBVROL-JXFKEZNVSA-N 1 1 340.423 4.346 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCO[C@H](c2ccccc2C)C1 ZINC000539808789 1040804794 /nfs/dbraw/zinc/80/47/94/1040804794.db2.gz XCHKOMKNEBVROL-JXFKEZNVSA-N 1 1 340.423 4.346 20 5 EIBDMO Cn1cccc1C[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000539818519 1040812735 /nfs/dbraw/zinc/81/27/35/1040812735.db2.gz UEHHFFRRTQUUNA-UHFFFAOYSA-N 1 1 341.436 4.294 20 5 EIBDMO C[C@H]1CCC[N@@H+](CCCCNc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000515550939 1040849365 /nfs/dbraw/zinc/84/93/65/1040849365.db2.gz YWYQQPIIJRRJIG-ZDUSSCGKSA-N 1 1 325.840 4.172 20 5 EIBDMO C[C@H]1CCSCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000483428331 1040852327 /nfs/dbraw/zinc/85/23/27/1040852327.db2.gz VNZDEDGRUNLJTH-ZDUSSCGKSA-N 1 1 332.425 4.182 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+][C@H]2COc3ccc(Cl)cc32)cc1[N+](=O)[O-] ZINC000537956259 1040925515 /nfs/dbraw/zinc/92/55/15/1040925515.db2.gz IYFCMSVXEFRRAX-ABAIWWIYSA-N 1 1 332.787 4.341 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+][C@H]2c3ccc(F)cc3O[C@H]2C)cc1[N+](=O)[O-] ZINC000554374088 1041060162 /nfs/dbraw/zinc/06/01/62/1041060162.db2.gz POPOTGAZFYJXDG-OAVHHTNSSA-N 1 1 330.359 4.215 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463036569 1041258876 /nfs/dbraw/zinc/25/88/76/1041258876.db2.gz USXFXUUGHAMJFZ-CABCVRRESA-N 1 1 330.350 4.456 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](COc2ccccc2)C1 ZINC000505861285 1041425471 /nfs/dbraw/zinc/42/54/71/1041425471.db2.gz CHCRBDYMLUBPEL-HOTGVXAUSA-N 1 1 326.396 4.057 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3ccc(Cl)cn3)C2)cc1 ZINC000516148351 1041429248 /nfs/dbraw/zinc/42/92/48/1041429248.db2.gz KESXPSLSIMKNSD-CQSZACIVSA-N 1 1 331.803 4.023 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCO[C@@](C)(c2ccccc2)C1 ZINC000538709456 1041483169 /nfs/dbraw/zinc/48/31/69/1041483169.db2.gz PVYOBXFOVRRDSJ-OXQOHEQNSA-N 1 1 340.423 4.212 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCO[C@@](C)(c2ccccc2)C1 ZINC000538709456 1041483172 /nfs/dbraw/zinc/48/31/72/1041483172.db2.gz PVYOBXFOVRRDSJ-OXQOHEQNSA-N 1 1 340.423 4.212 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@]2(C1)CCc1ccccc1O2 ZINC000554947372 1041506773 /nfs/dbraw/zinc/50/67/73/1041506773.db2.gz ZENVQQQLCFXIIU-YWZLYKJASA-N 1 1 338.407 4.126 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1cc2c(cccc2F)[nH]1)C1CC1 ZINC000437577699 1041844570 /nfs/dbraw/zinc/84/45/70/1041844570.db2.gz MRRNGJGEYKSYMF-UHFFFAOYSA-N 1 1 339.370 4.380 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cc2c(cccc2F)[nH]1)C1CC1 ZINC000437577699 1041844574 /nfs/dbraw/zinc/84/45/74/1041844574.db2.gz MRRNGJGEYKSYMF-UHFFFAOYSA-N 1 1 339.370 4.380 20 5 EIBDMO Cc1ccc(C[N@H+](C)Cc2ccccc2N2CCCC2)cc1[N+](=O)[O-] ZINC000506149043 1041942393 /nfs/dbraw/zinc/94/23/93/1041942393.db2.gz AVHHMHUYRISDTL-UHFFFAOYSA-N 1 1 339.439 4.135 20 5 EIBDMO CCC[N@@H+](CCc1cccs1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000464583410 1042075717 /nfs/dbraw/zinc/07/57/17/1042075717.db2.gz CHDQGUPTVIBKCT-UHFFFAOYSA-N 1 1 345.424 4.252 20 5 EIBDMO COc1ccc(C[N@@H+]2C[C@@H](C)C[C@H]2c2ccccc2F)cc1[N+](=O)[O-] ZINC000464725682 1042142507 /nfs/dbraw/zinc/14/25/07/1042142507.db2.gz ORQVTGADNXZRMC-GUYCJALGSA-N 1 1 344.386 4.326 20 5 EIBDMO COc1ccc(C[N@H+]2C[C@@H](C)C[C@H]2c2ccccc2F)cc1[N+](=O)[O-] ZINC000464725682 1042142513 /nfs/dbraw/zinc/14/25/13/1042142513.db2.gz ORQVTGADNXZRMC-GUYCJALGSA-N 1 1 344.386 4.326 20 5 EIBDMO CC[C@]1(C)CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000464776956 1042158679 /nfs/dbraw/zinc/15/86/79/1042158679.db2.gz LMLPSCUXDOGOJG-LJQANCHMSA-N 1 1 343.427 4.304 20 5 EIBDMO C[C@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@@H](c2ccco2)C1 ZINC000464858278 1042202335 /nfs/dbraw/zinc/20/23/35/1042202335.db2.gz OMBFQHGFHCWWLV-GOEBONIOSA-N 1 1 330.384 4.040 20 5 EIBDMO C[C@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@H](c2ccco2)C1 ZINC000464859005 1042202620 /nfs/dbraw/zinc/20/26/20/1042202620.db2.gz PPFNLQCISKCAQE-YOEHRIQHSA-N 1 1 330.384 4.040 20 5 EIBDMO C[C@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@@H](c2ccco2)C1 ZINC000464859004 1042202899 /nfs/dbraw/zinc/20/28/99/1042202899.db2.gz PPFNLQCISKCAQE-WMLDXEAASA-N 1 1 330.384 4.040 20 5 EIBDMO COc1ccccc1[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000108421321 1042410623 /nfs/dbraw/zinc/41/06/23/1042410623.db2.gz IIUZSWKADPWHDV-NRFANRHFSA-N 1 1 348.402 4.483 20 5 EIBDMO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000271821871 1042412656 /nfs/dbraw/zinc/41/26/56/1042412656.db2.gz SHPWHZJOTXZWNG-OLZOCXBDSA-N 1 1 330.432 4.267 20 5 EIBDMO CC[C@H](C)[N@H+](C)CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000518280235 1042450693 /nfs/dbraw/zinc/45/06/93/1042450693.db2.gz WKEAJDFFXNNRAW-AWEZNQCLSA-N 1 1 347.484 4.143 20 5 EIBDMO CC[C@H](C)[N@@H+](C)CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000518280235 1042450702 /nfs/dbraw/zinc/45/07/02/1042450702.db2.gz WKEAJDFFXNNRAW-AWEZNQCLSA-N 1 1 347.484 4.143 20 5 EIBDMO CCOc1cc(C[N@H+]([C@H](C)c2ccco2)C2CC2)ccc1[N+](=O)[O-] ZINC000492540400 1042692142 /nfs/dbraw/zinc/69/21/42/1042692142.db2.gz UQDSUTDJCUIUPO-CYBMUJFWSA-N 1 1 330.384 4.312 20 5 EIBDMO CCOc1cc(C[N@@H+]([C@H](C)c2ccco2)C2CC2)ccc1[N+](=O)[O-] ZINC000492540400 1042692147 /nfs/dbraw/zinc/69/21/47/1042692147.db2.gz UQDSUTDJCUIUPO-CYBMUJFWSA-N 1 1 330.384 4.312 20 5 EIBDMO CC(C)c1ccc(C[NH2+]Cc2ccc3c(n2)CCCC3)cc1[N+](=O)[O-] ZINC000444010058 1042787414 /nfs/dbraw/zinc/78/74/14/1042787414.db2.gz DVAJKLZHMSOXEG-UHFFFAOYSA-N 1 1 339.439 4.282 20 5 EIBDMO CCS[C@H]1CC[C@H]([N@H+](C)Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493136843 1042828247 /nfs/dbraw/zinc/82/82/47/1042828247.db2.gz ZYMLCOXQPBWZCP-RYUDHWBXSA-N 1 1 328.865 4.354 20 5 EIBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493136843 1042828249 /nfs/dbraw/zinc/82/82/49/1042828249.db2.gz ZYMLCOXQPBWZCP-RYUDHWBXSA-N 1 1 328.865 4.354 20 5 EIBDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761512408 1042873596 /nfs/dbraw/zinc/87/35/96/1042873596.db2.gz SVERNGPGJCMVSV-LBPRGKRZSA-N 1 1 334.803 4.017 20 5 EIBDMO CC[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761515236 1042874266 /nfs/dbraw/zinc/87/42/66/1042874266.db2.gz RXTXNCVXAJUXPF-MRXNPFEDSA-N 1 1 348.830 4.021 20 5 EIBDMO CCC(C)(C)[C@H]1CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000441652668 1042957679 /nfs/dbraw/zinc/95/76/79/1042957679.db2.gz BGQISMBDVWYRQW-OAHLLOKOSA-N 1 1 344.415 4.045 20 5 EIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1cccc2[nH]ccc21 ZINC000494036560 1043006330 /nfs/dbraw/zinc/00/63/30/1043006330.db2.gz FXHHORSTYYJETJ-UHFFFAOYSA-N 1 1 339.395 4.107 20 5 EIBDMO Cc1c(C[NH+]2CC(c3nc4ccccc4s3)C2)cccc1[N+](=O)[O-] ZINC000536471774 1043029524 /nfs/dbraw/zinc/02/95/24/1043029524.db2.gz JNZVJOJDVUFMGT-UHFFFAOYSA-N 1 1 339.420 4.112 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@@H]3/C=C\c3ccccc3)nc2c1 ZINC000611554676 1043046337 /nfs/dbraw/zinc/04/63/37/1043046337.db2.gz RVMCKORUPPJBLA-HLRDLLSLSA-N 1 1 349.390 4.414 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@H]3/C=C\c3ccccc3)nc2c1 ZINC000611554676 1043046347 /nfs/dbraw/zinc/04/63/47/1043046347.db2.gz RVMCKORUPPJBLA-HLRDLLSLSA-N 1 1 349.390 4.414 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(c3ccc(F)c(F)c3)CC2)cs1 ZINC000609194954 1043448526 /nfs/dbraw/zinc/44/85/26/1043448526.db2.gz UHFRBMHMZWOSFQ-UHFFFAOYSA-N 1 1 338.379 4.314 20 5 EIBDMO CC(C)c1ccc(C[NH2+]Cc2cnc(Cl)s2)cc1[N+](=O)[O-] ZINC000895155698 1043626440 /nfs/dbraw/zinc/62/64/40/1043626440.db2.gz LYSSHSKXDSHUNI-UHFFFAOYSA-N 1 1 325.821 4.118 20 5 EIBDMO Cc1c(C[N@@H+]2CCCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@@H]2O)cccc1[N+](=O)[O-] ZINC000438993677 1043741363 /nfs/dbraw/zinc/74/13/63/1043741363.db2.gz ACUJEQHOLGEVQH-OBZTVWKBSA-N 1 1 346.471 4.055 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](c2nccs2)C1 ZINC000245536682 1043969726 /nfs/dbraw/zinc/96/97/26/1043969726.db2.gz XRCMJIABLYPHHC-UONOGXRCSA-N 1 1 331.441 4.300 20 5 EIBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[C@@H](C)C1 ZINC000443063644 1043985202 /nfs/dbraw/zinc/98/52/02/1043985202.db2.gz DLCYPOCNFNAOAV-BBRMVZONSA-N 1 1 346.452 4.323 20 5 EIBDMO CC[N@@H+](Cc1cccc(Br)c1)Cc1cccc([N+](=O)[O-])c1 ZINC000521858818 1044033928 /nfs/dbraw/zinc/03/39/28/1044033928.db2.gz RDQBPXDWVJCZTH-UHFFFAOYSA-N 1 1 349.228 4.379 20 5 EIBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H]2c2ccc(F)c(F)c2)c1 ZINC000732988599 1044063925 /nfs/dbraw/zinc/06/39/25/1044063925.db2.gz JJNOEBAHTWWQJB-SFHVURJKSA-N 1 1 348.349 4.089 20 5 EIBDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000543247893 1044236816 /nfs/dbraw/zinc/23/68/16/1044236816.db2.gz ZBBBNNHVMVEGEX-AWEZNQCLSA-N 1 1 329.400 4.118 20 5 EIBDMO COc1c2ccccc2oc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000474044947 1044284311 /nfs/dbraw/zinc/28/43/11/1044284311.db2.gz OQGGRAQXASRJJR-GFCCVEGCSA-N 1 1 326.352 4.200 20 5 EIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](C)C[C@H](C)C1 ZINC000246485224 1044318044 /nfs/dbraw/zinc/31/80/44/1044318044.db2.gz AHOHHBNAHXWVSK-RDBSUJKOSA-N 1 1 344.415 4.074 20 5 EIBDMO CC(C)(O)C[N@H+](Cc1ccccc1)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000494811439 1044338807 /nfs/dbraw/zinc/33/88/07/1044338807.db2.gz LCCUCCKZZANWQF-UHFFFAOYSA-N 1 1 348.830 4.021 20 5 EIBDMO CC(C)(O)C[N@@H+](Cc1ccccc1)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000494811439 1044338826 /nfs/dbraw/zinc/33/88/26/1044338826.db2.gz LCCUCCKZZANWQF-UHFFFAOYSA-N 1 1 348.830 4.021 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccc(OC(F)F)cc1 ZINC000487861997 1044794949 /nfs/dbraw/zinc/79/49/49/1044794949.db2.gz SCWSYQXPIXIZPU-GFCCVEGCSA-N 1 1 336.338 4.389 20 5 EIBDMO C[C@H](NC[C@@H](c1ccccc1)[NH+]1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000327258669 1044797967 /nfs/dbraw/zinc/79/79/67/1044797967.db2.gz CSUONEMHLXJKOR-JXFKEZNVSA-N 1 1 339.439 4.083 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC000025360101 1044843772 /nfs/dbraw/zinc/84/37/72/1044843772.db2.gz FURGTYBCNSLRBE-KRWDZBQOSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC000025360101 1044843773 /nfs/dbraw/zinc/84/37/73/1044843773.db2.gz FURGTYBCNSLRBE-KRWDZBQOSA-N 1 1 330.359 4.080 20 5 EIBDMO C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1cc(Cl)cc2c1OCC2 ZINC000922987837 1044889249 /nfs/dbraw/zinc/88/92/49/1044889249.db2.gz WZANVGQTGFNSIO-VIFPVBQESA-N 1 1 338.816 4.095 20 5 EIBDMO C[C@H](Cc1ccc(Cl)cc1)[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000736624122 1044956927 /nfs/dbraw/zinc/95/69/27/1044956927.db2.gz XTLGVGVWVDGUPL-GFCCVEGCSA-N 1 1 336.794 4.450 20 5 EIBDMO CC(C)[C@@H]([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)c1ccc(F)cc1 ZINC000509381317 1045067683 /nfs/dbraw/zinc/06/76/83/1045067683.db2.gz XQQSEQNLAQTBLN-QGZVFWFLSA-N 1 1 338.329 4.499 20 5 EIBDMO Cc1cc(NC2CC[NH+](C(C)(C)C)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302129834 1045162097 /nfs/dbraw/zinc/16/20/97/1045162097.db2.gz BQHBHGLGSHXLRA-UHFFFAOYSA-N 1 1 342.443 4.126 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1nccc2ccccc21)C1CC1 ZINC000611254789 1045266438 /nfs/dbraw/zinc/26/64/38/1045266438.db2.gz GZSPCLKKXFPQRS-UHFFFAOYSA-N 1 1 333.391 4.308 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1nccc2ccccc21)C1CC1 ZINC000611254789 1045266444 /nfs/dbraw/zinc/26/64/44/1045266444.db2.gz GZSPCLKKXFPQRS-UHFFFAOYSA-N 1 1 333.391 4.308 20 5 EIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000611268261 1045271089 /nfs/dbraw/zinc/27/10/89/1045271089.db2.gz DXBPAWNVBIKVBN-HSSRVXSRSA-N 1 1 338.407 4.072 20 5 EIBDMO CC1(C)C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCCO1 ZINC000611272431 1045272304 /nfs/dbraw/zinc/27/23/04/1045272304.db2.gz MGVCYXOZRWHSMK-UHFFFAOYSA-N 1 1 346.452 4.324 20 5 EIBDMO CCOc1ccc([C@H](C)[NH2+][C@@H](CCOC)c2ccco2)cc1[N+](=O)[O-] ZINC000272487869 1045490983 /nfs/dbraw/zinc/49/09/83/1045490983.db2.gz BXEPPBCZFDCEQQ-ZFWWWQNUSA-N 1 1 348.399 4.015 20 5 EIBDMO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1cccc([N+](=O)[O-])c1)CCC2 ZINC000152455645 1045732026 /nfs/dbraw/zinc/73/20/26/1045732026.db2.gz CAGQIOCNIGQFCH-HNNXBMFYSA-N 1 1 331.441 4.123 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1cc(-c2ccccc2)n[nH]1 ZINC000768205950 1045742660 /nfs/dbraw/zinc/74/26/60/1045742660.db2.gz CIROISUHWQOCIX-CQSZACIVSA-N 1 1 336.395 4.178 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1cc(-c2ccccc2)n[nH]1 ZINC000768205950 1045742672 /nfs/dbraw/zinc/74/26/72/1045742672.db2.gz CIROISUHWQOCIX-CQSZACIVSA-N 1 1 336.395 4.178 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+](C2CC2)C2CCCC2)ccc1Br ZINC000768252350 1045762161 /nfs/dbraw/zinc/76/21/61/1045762161.db2.gz KITJDFPYQHUHMS-UHFFFAOYSA-N 1 1 339.233 4.264 20 5 EIBDMO C[C@@H](C1CC1)[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C1CC1 ZINC000768532821 1045817157 /nfs/dbraw/zinc/81/71/57/1045817157.db2.gz ODVZAWFEVOHNSC-JTQLQIEISA-N 1 1 339.233 4.120 20 5 EIBDMO O=C1CCCN1[C@H]1CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000792187493 1045876935 /nfs/dbraw/zinc/87/69/35/1045876935.db2.gz SBBALSBYABIGHH-IBGZPJMESA-N 1 1 344.458 4.190 20 5 EIBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](CC(C)C)[C@@H](C)c1ccccc1C ZINC001170244611 1045949717 /nfs/dbraw/zinc/94/97/17/1045949717.db2.gz NQTMHKZRJDQXLR-INIZCTEOSA-N 1 1 344.459 4.127 20 5 EIBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001170327160 1045999235 /nfs/dbraw/zinc/99/92/35/1045999235.db2.gz FFELGILYTVCCJR-YJBOKZPZSA-N 1 1 340.423 4.024 20 5 EIBDMO COCCOC[C@H]1CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000769509350 1046004725 /nfs/dbraw/zinc/00/47/25/1046004725.db2.gz WTXBLGXLSNTQDD-SFHVURJKSA-N 1 1 349.474 4.478 20 5 EIBDMO COc1ccc(C[C@H](C)[N@@H+](C)Cc2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC001170343517 1046021416 /nfs/dbraw/zinc/02/14/16/1046021416.db2.gz PVEWFDLLUJNELD-ZDUSSCGKSA-N 1 1 348.830 4.320 20 5 EIBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC001170347168 1046023747 /nfs/dbraw/zinc/02/37/47/1046023747.db2.gz QYRVBLAPXDIHTG-XJKSGUPXSA-N 1 1 346.452 4.433 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCCC[C@@H]2c2ccco2)c([N+](=O)[O-])c1 ZINC000792868295 1046081030 /nfs/dbraw/zinc/08/10/30/1046081030.db2.gz SVMRKDPEASGBRZ-OAHLLOKOSA-N 1 1 345.355 4.213 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCCC[C@@H]2c2ccco2)c([N+](=O)[O-])c1 ZINC000792868295 1046081049 /nfs/dbraw/zinc/08/10/49/1046081049.db2.gz SVMRKDPEASGBRZ-OAHLLOKOSA-N 1 1 345.355 4.213 20 5 EIBDMO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000792877256 1046091569 /nfs/dbraw/zinc/09/15/69/1046091569.db2.gz RNZMAMKLGQZNQO-OAHLLOKOSA-N 1 1 349.774 4.397 20 5 EIBDMO COCc1cccc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC001170423500 1046115784 /nfs/dbraw/zinc/11/57/84/1046115784.db2.gz GXCZIBMAYKBLLK-LJQANCHMSA-N 1 1 340.423 4.121 20 5 EIBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H](O)c1ccc(Cl)cc1 ZINC000771579333 1046448606 /nfs/dbraw/zinc/44/86/06/1046448606.db2.gz MZOFLPNHVPQJHB-SFHVURJKSA-N 1 1 348.830 4.192 20 5 EIBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)CC1(O)CCCC1 ZINC000536667719 1046620222 /nfs/dbraw/zinc/62/02/22/1046620222.db2.gz NRVSAUCVDWRDKB-UHFFFAOYSA-N 1 1 346.452 4.060 20 5 EIBDMO CC(C)CCOC1CC[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000746659827 1046931152 /nfs/dbraw/zinc/93/11/52/1046931152.db2.gz ZPWFUKWJXWCVAD-UHFFFAOYSA-N 1 1 340.851 4.275 20 5 EIBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000746672704 1046985799 /nfs/dbraw/zinc/98/57/99/1046985799.db2.gz HFDJHDXENSISPR-KGLIPLIRSA-N 1 1 328.865 4.354 20 5 EIBDMO C[C@H]1C[C@@H](c2cccnc2)[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000805749733 1047000304 /nfs/dbraw/zinc/00/03/04/1047000304.db2.gz QZAATMJFDDWHNN-SJCJKPOMSA-N 1 1 331.803 4.226 20 5 EIBDMO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000805749733 1047000322 /nfs/dbraw/zinc/00/03/22/1047000322.db2.gz QZAATMJFDDWHNN-SJCJKPOMSA-N 1 1 331.803 4.226 20 5 EIBDMO CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000805835249 1047025091 /nfs/dbraw/zinc/02/50/91/1047025091.db2.gz LXKQMBOLCREOOX-INIZCTEOSA-N 1 1 332.375 4.326 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1OC(F)(F)F ZINC000089512409 1047784141 /nfs/dbraw/zinc/78/41/41/1047784141.db2.gz BUMMBGNQVVDTQH-LLVKDONJSA-N 1 1 340.301 4.344 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1Cc2ccccc2O[C@H](C)C1 ZINC001170733091 1047877538 /nfs/dbraw/zinc/87/75/38/1047877538.db2.gz PXJBBMIFBMHNIX-HUUCEWRRSA-N 1 1 326.396 4.247 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1Cc2ccccc2O[C@H](C)C1 ZINC001170733091 1047877542 /nfs/dbraw/zinc/87/75/42/1047877542.db2.gz PXJBBMIFBMHNIX-HUUCEWRRSA-N 1 1 326.396 4.247 20 5 EIBDMO COC[C@H]1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000825321303 1048069304 /nfs/dbraw/zinc/06/93/04/1048069304.db2.gz BYTSZGAEQSKYPI-NSHDSACASA-N 1 1 347.242 4.150 20 5 EIBDMO COC[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000825321303 1048069318 /nfs/dbraw/zinc/06/93/18/1048069318.db2.gz BYTSZGAEQSKYPI-NSHDSACASA-N 1 1 347.242 4.150 20 5 EIBDMO C[C@H](CO)[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C1CCCC1 ZINC000809984781 1048589750 /nfs/dbraw/zinc/58/97/50/1048589750.db2.gz ZFDQPUGMPSTFFR-SNVBAGLBSA-N 1 1 347.242 4.027 20 5 EIBDMO CCC[C@@]1(CO)CCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809990337 1048592268 /nfs/dbraw/zinc/59/22/68/1048592268.db2.gz RPDUQMIARNNHDH-HNNXBMFYSA-N 1 1 347.242 4.029 20 5 EIBDMO CCC[C@@]1(CO)CCC[N@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809990337 1048592283 /nfs/dbraw/zinc/59/22/83/1048592283.db2.gz RPDUQMIARNNHDH-HNNXBMFYSA-N 1 1 347.242 4.029 20 5 EIBDMO C[C@H](O)C[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809998354 1048600161 /nfs/dbraw/zinc/60/01/61/1048600161.db2.gz OXNGVRYKYYTNHW-GWCFXTLKSA-N 1 1 347.242 4.027 20 5 EIBDMO C[C@H](O)C[C@@H]1CCCC[N@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809998354 1048600168 /nfs/dbraw/zinc/60/01/68/1048600168.db2.gz OXNGVRYKYYTNHW-GWCFXTLKSA-N 1 1 347.242 4.027 20 5 EIBDMO c1nc2c([nH]1)CC[C@@H]([NH2+]Cc1c3ccccc3cc3ccccc31)C2 ZINC000810171736 1048653098 /nfs/dbraw/zinc/65/30/98/1048653098.db2.gz RSPFSDWGLRYQBX-QGZVFWFLSA-N 1 1 327.431 4.363 20 5 EIBDMO CC(C)[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H](C)c1ccsc1 ZINC000817287204 1048927576 /nfs/dbraw/zinc/92/75/76/1048927576.db2.gz LFQJWKXIADKCJD-DYVFJYSZSA-N 1 1 334.441 4.161 20 5 EIBDMO CC(C)[N@@H+](CCCOc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350278 1049052008 /nfs/dbraw/zinc/05/20/08/1049052008.db2.gz UNTISYDJWMPYCA-UHFFFAOYSA-N 1 1 328.412 4.274 20 5 EIBDMO COc1ccc(C[N@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])cc1C ZINC000609705019 1049278578 /nfs/dbraw/zinc/27/85/78/1049278578.db2.gz GFXGOXIDBNAOOE-UHFFFAOYSA-N 1 1 334.803 4.197 20 5 EIBDMO COc1ccc(C[N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])cc1C ZINC000609705019 1049278593 /nfs/dbraw/zinc/27/85/93/1049278593.db2.gz GFXGOXIDBNAOOE-UHFFFAOYSA-N 1 1 334.803 4.197 20 5 EIBDMO Cc1ccccc1OCC[N@@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609704802 1049280007 /nfs/dbraw/zinc/28/00/07/1049280007.db2.gz MJAAWBSRIYYHSY-UHFFFAOYSA-N 1 1 334.803 4.067 20 5 EIBDMO Cc1ccccc1OCC[N@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609704802 1049280022 /nfs/dbraw/zinc/28/00/22/1049280022.db2.gz MJAAWBSRIYYHSY-UHFFFAOYSA-N 1 1 334.803 4.067 20 5 EIBDMO C[C@@H](Cc1ccc(Cl)cc1)[N@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000609915501 1049393969 /nfs/dbraw/zinc/39/39/69/1049393969.db2.gz BJAFZKNFTXQQJK-LBPRGKRZSA-N 1 1 336.794 4.450 20 5 EIBDMO C[C@@H](Cc1ccc(Cl)cc1)[N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000609915501 1049393987 /nfs/dbraw/zinc/39/39/87/1049393987.db2.gz BJAFZKNFTXQQJK-LBPRGKRZSA-N 1 1 336.794 4.450 20 5 EIBDMO COc1ccc(C[N@H+]2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000609916144 1049396528 /nfs/dbraw/zinc/39/65/28/1049396528.db2.gz AHUVLXNLCDYKHP-BBRMVZONSA-N 1 1 344.386 4.121 20 5 EIBDMO Cc1ccccc1[C@H]1C[C@H](C)[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000610001877 1049469352 /nfs/dbraw/zinc/46/93/52/1049469352.db2.gz JKFCKLTXDCFMEE-GJZGRUSLSA-N 1 1 328.387 4.420 20 5 EIBDMO CC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@H](C)[C@@H](O)c1ccccc1 ZINC000812849680 1049610691 /nfs/dbraw/zinc/61/06/91/1049610691.db2.gz RFAHPSYOPDTLGW-FZKQIMNGSA-N 1 1 348.830 4.192 20 5 EIBDMO CCOc1cc(C[N@@H+]2CCCc3sccc3C2)ccc1[N+](=O)[O-] ZINC000617198835 1049965945 /nfs/dbraw/zinc/96/59/45/1049965945.db2.gz QGDDBJMZDXUCEW-UHFFFAOYSA-N 1 1 332.425 4.003 20 5 EIBDMO CCOc1cc(C[N@H+]2CCCc3sccc3C2)ccc1[N+](=O)[O-] ZINC000617198835 1049965949 /nfs/dbraw/zinc/96/59/49/1049965949.db2.gz QGDDBJMZDXUCEW-UHFFFAOYSA-N 1 1 332.425 4.003 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCC[C@H]1c1nccs1)CC2 ZINC001172920988 1050233846 /nfs/dbraw/zinc/23/38/46/1050233846.db2.gz NFEHZQREECSRBT-WBVHZDCISA-N 1 1 343.452 4.136 20 5 EIBDMO C[N@@H+](Cc1ccc(F)cc1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172910384 1050245426 /nfs/dbraw/zinc/24/54/26/1050245426.db2.gz YNPAEADJMSQPFO-GOSISDBHSA-N 1 1 328.387 4.113 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCC[C@@H]1c1ccccn1)CC2 ZINC001172912638 1050246334 /nfs/dbraw/zinc/24/63/34/1050246334.db2.gz BZOGHFRKZPCBKF-YLJYHZDGSA-N 1 1 337.423 4.074 20 5 EIBDMO C[N@@H+](Cc1cccc(F)c1F)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172912773 1050247552 /nfs/dbraw/zinc/24/75/52/1050247552.db2.gz MCFYVBBDDQVHIE-INIZCTEOSA-N 1 1 346.377 4.252 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1NC[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC001186285231 1050282191 /nfs/dbraw/zinc/28/21/91/1050282191.db2.gz OWCVXGOFGDKVLE-HNNXBMFYSA-N 1 1 337.851 4.457 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC001173227224 1050357435 /nfs/dbraw/zinc/35/74/35/1050357435.db2.gz ONRWLOUFZFGPOI-ZBFHGGJFSA-N 1 1 328.387 4.154 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](Oc2ccccc2)C1 ZINC001173224954 1050357587 /nfs/dbraw/zinc/35/75/87/1050357587.db2.gz AASMJKPGVIJDIZ-UZLBHIALSA-N 1 1 340.423 4.069 20 5 EIBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173231866 1050358838 /nfs/dbraw/zinc/35/88/38/1050358838.db2.gz OEOCZKLIINSKNS-JKSUJKDBSA-N 1 1 342.439 4.097 20 5 EIBDMO COc1ccc([C@H](C)[N@@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173234499 1050361801 /nfs/dbraw/zinc/36/18/01/1050361801.db2.gz RSPFFCBLXVFUCD-CABCVRRESA-N 1 1 328.412 4.227 20 5 EIBDMO Cc1ccc([C@@H]2CCC[N@@H+]2[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cn1 ZINC001173233704 1050362200 /nfs/dbraw/zinc/36/22/00/1050362200.db2.gz MFDZYYDBVZFRPO-KXBFYZLASA-N 1 1 325.412 4.066 20 5 EIBDMO CCC[N@@H+](CC)C[C@@H](C)Nc1c(Cl)c(Cl)ccc1[N+](=O)[O-] ZINC001186602823 1050375641 /nfs/dbraw/zinc/37/56/41/1050375641.db2.gz VZYHXPPWAVXHDK-SNVBAGLBSA-N 1 1 334.247 4.434 20 5 EIBDMO CC(C)C[N@@H+](C)CCCNc1cccc(C(F)(F)F)c1[N+](=O)[O-] ZINC001186914619 1050446108 /nfs/dbraw/zinc/44/61/08/1050446108.db2.gz NSRQKNPSJKFQKX-UHFFFAOYSA-N 1 1 333.354 4.003 20 5 EIBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](C3CCCCC3)C2)c(C(F)F)c1 ZINC001187080852 1050478641 /nfs/dbraw/zinc/47/86/41/1050478641.db2.gz FJUCIBBXVVTVCY-LBPRGKRZSA-N 1 1 339.386 4.351 20 5 EIBDMO Cc1cc(Br)cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC001180012248 1050854695 /nfs/dbraw/zinc/85/46/95/1050854695.db2.gz YOVPVRQRMBUHAO-UHFFFAOYSA-N 1 1 349.228 4.298 20 5 EIBDMO Cc1cc(Br)cc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC001180012248 1050854700 /nfs/dbraw/zinc/85/47/00/1050854700.db2.gz YOVPVRQRMBUHAO-UHFFFAOYSA-N 1 1 349.228 4.298 20 5 EIBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001180183344 1050895284 /nfs/dbraw/zinc/89/52/84/1050895284.db2.gz BVQMWOYROOLHNU-OAHLLOKOSA-N 1 1 342.439 4.283 20 5 EIBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1nc(C(C)(C)C)cs1 ZINC000619785241 1050900109 /nfs/dbraw/zinc/90/01/09/1050900109.db2.gz SCGJEZWMEZNHEN-UHFFFAOYSA-N 1 1 333.457 4.023 20 5 EIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1nc(C(C)(C)C)cs1 ZINC000619785241 1050900122 /nfs/dbraw/zinc/90/01/22/1050900122.db2.gz SCGJEZWMEZNHEN-UHFFFAOYSA-N 1 1 333.457 4.023 20 5 EIBDMO C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2cc(Br)c([N+](=O)[O-])s2)C1 ZINC001180392495 1050978096 /nfs/dbraw/zinc/97/80/96/1050978096.db2.gz FPRADFOEGBMSFJ-NXEZZACHSA-N 1 1 347.278 4.429 20 5 EIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+](Cc1ccccc1F)CC1CC1 ZINC001174680679 1051116645 /nfs/dbraw/zinc/11/66/45/1051116645.db2.gz MUEUPSJSKRERJX-UHFFFAOYSA-N 1 1 344.386 4.025 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](Oc2ccccc2)C1 ZINC001174742486 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NIZWZEHXSOIPJY-UHFFFAOYSA-N 1 1 330.815 4.455 20 5 EIBDMO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774832647 1052181401 /nfs/dbraw/zinc/18/14/01/1052181401.db2.gz KKYBUPNHDOQVDZ-QGZVFWFLSA-N 1 1 341.367 4.149 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+](Cc3ccc(F)cc3)C3CC3)nc2c1 ZINC000083132099 1052833640 /nfs/dbraw/zinc/83/36/40/1052833640.db2.gz BAKQZJHNZIJSCM-UHFFFAOYSA-N 1 1 341.342 4.040 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+](Cc3ccc(F)cc3)C3CC3)nc2c1 ZINC000083132099 1052833644 /nfs/dbraw/zinc/83/36/44/1052833644.db2.gz BAKQZJHNZIJSCM-UHFFFAOYSA-N 1 1 341.342 4.040 20 5 EIBDMO CCCC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC001194674131 1053069365 /nfs/dbraw/zinc/06/93/65/1053069365.db2.gz BVTVGKXNCBTSLA-UHFFFAOYSA-N 1 1 347.459 4.358 20 5 EIBDMO C[C@@H](Cc1cccc(F)c1)[N@H+](C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC001195013843 1053209494 /nfs/dbraw/zinc/20/94/94/1053209494.db2.gz LYQAOAIIIORHQS-NSHDSACASA-N 1 1 338.329 4.075 20 5 EIBDMO C[C@@H](Cc1cccc(F)c1)[N@@H+](C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC001195013843 1053209529 /nfs/dbraw/zinc/20/95/29/1053209529.db2.gz LYQAOAIIIORHQS-NSHDSACASA-N 1 1 338.329 4.075 20 5 EIBDMO CC(C)OCCC[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000552070848 1053385374 /nfs/dbraw/zinc/38/53/74/1053385374.db2.gz GKJBLDSRCLGSPZ-UHFFFAOYSA-N 1 1 332.400 4.102 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)CCc2ccc(F)cc21 ZINC001195704659 1053464512 /nfs/dbraw/zinc/46/45/12/1053464512.db2.gz OWKSNHUGSHOAEF-GFCCVEGCSA-N 1 1 332.350 4.035 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc(OC(F)F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000865418082 1053497289 /nfs/dbraw/zinc/49/72/89/1053497289.db2.gz HPGAQGLSULPOFO-SNVBAGLBSA-N 1 1 340.301 4.186 20 5 EIBDMO C[C@H]([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)c1ccc2c(c1)CCCO2 ZINC000852779880 1053610679 /nfs/dbraw/zinc/61/06/79/1053610679.db2.gz GCQBLLAZYWWXME-NSHDSACASA-N 1 1 348.349 4.049 20 5 EIBDMO Cc1c(C[N@@H+]2CCc3ccc(Cl)c(C)c3C2)cccc1[N+](=O)[O-] ZINC001197167229 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/nfs/dbraw/zinc/93/25/50/1053932550.db2.gz KQKADVBJKJEQIZ-LSDHHAIUSA-N 1 1 342.443 4.382 20 5 EIBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)c1c(C)noc1C ZINC000872035171 1054350932 /nfs/dbraw/zinc/35/09/32/1054350932.db2.gz NJRXIUJVRMTDPC-VHSXEESVSA-N 1 1 335.429 4.333 20 5 EIBDMO COc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872043465 1054355128 /nfs/dbraw/zinc/35/51/28/1054355128.db2.gz ICCBIGXAMJCPKP-NHYWBVRUSA-N 1 1 330.359 4.081 20 5 EIBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc(Cl)cn1 ZINC000872054329 1054364645 /nfs/dbraw/zinc/36/46/45/1054364645.db2.gz TWZZYKWTVXBRIS-JTQLQIEISA-N 1 1 337.832 4.216 20 5 EIBDMO CC(C)[C@H](O)[C@@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000872088752 1054384492 /nfs/dbraw/zinc/38/44/92/1054384492.db2.gz PXLBPUGDRNIMMR-AGRHKRQWSA-N 1 1 346.402 4.143 20 5 EIBDMO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000878057912 1055182324 /nfs/dbraw/zinc/18/23/24/1055182324.db2.gz RDQKAGGDKYZORV-CHWSQXEVSA-N 1 1 344.415 4.044 20 5 EIBDMO C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000301561586 1055731762 /nfs/dbraw/zinc/73/17/62/1055731762.db2.gz UXKWDNSFYFRHCI-CRAIPNDOSA-N 1 1 325.412 4.060 20 5 EIBDMO CC(C)[N@H+](C)Cc1nc(-c2c3ccccc3nc3ccccc32)no1 ZINC000624754476 1056059711 /nfs/dbraw/zinc/05/97/11/1056059711.db2.gz VPRLHXJOHMWOSG-UHFFFAOYSA-N 1 1 332.407 4.278 20 5 EIBDMO CC(C)[N@@H+](C)Cc1nc(-c2c3ccccc3nc3ccccc32)no1 ZINC000624754476 1056059725 /nfs/dbraw/zinc/05/97/25/1056059725.db2.gz VPRLHXJOHMWOSG-UHFFFAOYSA-N 1 1 332.407 4.278 20 5 EIBDMO CCOc1ccc([C@H](C)[NH2+][C@@H](C)c2c(C)noc2C)cc1[N+](=O)[O-] ZINC000153789785 1056209427 /nfs/dbraw/zinc/20/94/27/1056209427.db2.gz NBBJSWVQZNDHSP-QWRGUYRKSA-N 1 1 333.388 4.010 20 5 EIBDMO COc1ccc2c(c1)CCC[C@H]2[N@@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000746140551 1060039931 /nfs/dbraw/zinc/03/99/31/1060039931.db2.gz NBBZIMQIKPNYEE-HXUWFJFHSA-N 1 1 340.423 4.421 20 5 EIBDMO C[N@@H+](Cc1ccccc1Oc1ccccc1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169035194 1060591470 /nfs/dbraw/zinc/59/14/70/1060591470.db2.gz BJRPIAYNGIEQEL-FUHWJXTLSA-N 1 1 340.423 4.356 20 5 EIBDMO C[N@@H+](Cc1ccccc1Oc1ccccc1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169035193 1060592222 /nfs/dbraw/zinc/59/22/22/1060592222.db2.gz BJRPIAYNGIEQEL-AEFFLSMTSA-N 1 1 340.423 4.356 20 5 EIBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC001169048365 1060601405 /nfs/dbraw/zinc/60/14/05/1060601405.db2.gz UWFKAZCZFNCUJF-UHOFOFEASA-N 1 1 342.361 4.288 20 5 EIBDMO C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c3c2CC[N@H+](C)C3)c2ccccc21 ZINC001169379957 1060792644 /nfs/dbraw/zinc/79/26/44/1060792644.db2.gz PAMIRJOYZRZLTE-DJJJIMSYSA-N 1 1 337.423 4.243 20 5 EIBDMO C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c3c2CC[N@@H+](C)C3)c2ccccc21 ZINC001169379957 1060792663 /nfs/dbraw/zinc/79/26/63/1060792663.db2.gz PAMIRJOYZRZLTE-DJJJIMSYSA-N 1 1 337.423 4.243 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(C(=O)c2ccccc2)CC1 ZINC000036811517 526080095 /nfs/dbraw/zinc/08/00/95/526080095.db2.gz WSIWFQXAXXUUHA-HNNXBMFYSA-N 1 1 338.407 4.251 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cc2cccc(F)c2o1 ZINC000475692862 1032159548 /nfs/dbraw/zinc/15/95/48/1032159548.db2.gz BYVYHIQLGGTTNJ-NSHDSACASA-N 1 1 344.342 4.340 20 5 EIBDMO CC[C@@H](C)[C@H](C)[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CC1 ZINC000532963255 1032413540 /nfs/dbraw/zinc/41/35/40/1032413540.db2.gz BKXFERBNNMMWJQ-OLZOCXBDSA-N 1 1 344.415 4.044 20 5 EIBDMO C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000475721412 1032501862 /nfs/dbraw/zinc/50/18/62/1032501862.db2.gz AZNFBCZTZKPUIA-QLFBSQMISA-N 1 1 343.427 4.159 20 5 EIBDMO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000533289468 1032605822 /nfs/dbraw/zinc/60/58/22/1032605822.db2.gz LOZVYPZBSQJYEB-CZUORRHYSA-N 1 1 344.415 4.045 20 5 EIBDMO COc1ccsc1[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000274625850 1018846758 /nfs/dbraw/zinc/84/67/58/1018846758.db2.gz XYMUSSWEBCMCRA-VIFPVBQESA-N 1 1 326.805 4.169 20 5 EIBDMO C[N@@H+]1CCc2c(NCc3ccccc3C3CC3)ccc([N+](=O)[O-])c2C1 ZINC001167052365 1018904229 /nfs/dbraw/zinc/90/42/29/1018904229.db2.gz NEHVSFBUXNYWKF-UHFFFAOYSA-N 1 1 337.423 4.072 20 5 EIBDMO C[N@H+]1CCc2c(NCc3ccccc3C3CC3)ccc([N+](=O)[O-])c2C1 ZINC001167052365 1018904241 /nfs/dbraw/zinc/90/42/41/1018904241.db2.gz NEHVSFBUXNYWKF-UHFFFAOYSA-N 1 1 337.423 4.072 20 5 EIBDMO CC(C)(C)OC1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000154318742 1019719486 /nfs/dbraw/zinc/71/94/86/1019719486.db2.gz LDNNCJAWYWEWFK-UHFFFAOYSA-N 1 1 326.824 4.028 20 5 EIBDMO COCC[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000609705392 1020031574 /nfs/dbraw/zinc/03/15/74/1020031574.db2.gz YSPFJKADTYQKLC-CQSZACIVSA-N 1 1 348.830 4.458 20 5 EIBDMO COCC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000609705392 1020031587 /nfs/dbraw/zinc/03/15/87/1020031587.db2.gz YSPFJKADTYQKLC-CQSZACIVSA-N 1 1 348.830 4.458 20 5 EIBDMO Cc1cc(C=C2CC[NH+](C/C=C/c3ccccc3[N+](=O)[O-])CC2)no1 ZINC000360040126 1020203533 /nfs/dbraw/zinc/20/35/33/1020203533.db2.gz LYZGOXQVYRXRDJ-GQCTYLIASA-N 1 1 339.395 4.084 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@H]2c2ccc(C)s2)cc1[N+](=O)[O-] ZINC000261474552 1021035328 /nfs/dbraw/zinc/03/53/28/1021035328.db2.gz KGURWYVQLKNAQM-AWEZNQCLSA-N 1 1 332.425 4.310 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCN(c2cccc(Cl)c2)CC1 ZINC000023699632 1021156757 /nfs/dbraw/zinc/15/67/57/1021156757.db2.gz ONSQLNSIQGLQHG-AWEZNQCLSA-N 1 1 345.830 4.131 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000610369756 1021548239 /nfs/dbraw/zinc/54/82/39/1021548239.db2.gz SSJYTLQQDMOKQJ-RDTXWAMCSA-N 1 1 328.437 4.446 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](CSc3ccccc3)C2)cc1 ZINC000610370722 1021551568 /nfs/dbraw/zinc/55/15/68/1021551568.db2.gz PHKYRJGAAKXWGI-INIZCTEOSA-N 1 1 328.437 4.209 20 5 EIBDMO CC(C)([NH2+]Cc1ncccc1C(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000613042860 1021659361 /nfs/dbraw/zinc/65/93/61/1021659361.db2.gz TZPDLYJHKZWRMU-UHFFFAOYSA-N 1 1 339.317 4.034 20 5 EIBDMO CC[C@H]1CCCCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000580604606 1021805955 /nfs/dbraw/zinc/80/59/55/1021805955.db2.gz LRVXCNIESYCVFH-INIZCTEOSA-N 1 1 343.427 4.447 20 5 EIBDMO COc1cccc(F)c1[C@H](C)[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000582191672 1021928724 /nfs/dbraw/zinc/92/87/24/1021928724.db2.gz GWKDEWAIJIQBED-NHYWBVRUSA-N 1 1 330.359 4.081 20 5 EIBDMO Cc1c([C@H](C)[NH2+][C@@H]2COc3ccc(Cl)cc32)cccc1[N+](=O)[O-] ZINC000536850457 1022026102 /nfs/dbraw/zinc/02/61/02/1022026102.db2.gz GZQCPYBPWHDACH-XHDPSFHLSA-N 1 1 332.787 4.341 20 5 EIBDMO Cc1nc2c(s1)[C@@H]([N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-])CCC2 ZINC000255524113 1022031382 /nfs/dbraw/zinc/03/13/82/1022031382.db2.gz MZXOWNKYICRHEQ-QLBOMPFWSA-N 1 1 343.452 4.382 20 5 EIBDMO C[C@@H]1CCC(C)(C)[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000452012699 1022215647 /nfs/dbraw/zinc/21/56/47/1022215647.db2.gz SHYRBWJIIYJKMO-CYBMUJFWSA-N 1 1 329.400 4.055 20 5 EIBDMO Cc1c([C@H](C)[NH2+]Cc2csc(-c3ccco3)n2)cccc1[N+](=O)[O-] ZINC000128427816 1022399881 /nfs/dbraw/zinc/39/98/81/1022399881.db2.gz BOJUAAAMWCDSCC-LBPRGKRZSA-N 1 1 343.408 4.471 20 5 EIBDMO Cc1ccc2cc(C[N@@H+](C)CCc3cccc([N+](=O)[O-])c3)ccc2n1 ZINC000549407252 1022566406 /nfs/dbraw/zinc/56/64/06/1022566406.db2.gz FONVAUVHQXHKJA-UHFFFAOYSA-N 1 1 335.407 4.126 20 5 EIBDMO CCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1C[C@H](OCC)C1(C)C ZINC001167443290 1022808615 /nfs/dbraw/zinc/80/86/15/1022808615.db2.gz RMDQIBORKPLOPS-MSOLQXFVSA-N 1 1 334.460 4.053 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCS[C@@H](c3ccccc3)C2)c(F)c1 ZINC000610476399 1022820389 /nfs/dbraw/zinc/82/03/89/1022820389.db2.gz LMZFRRQQHSLDKO-QGZVFWFLSA-N 1 1 332.400 4.024 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCS[C@@H](c3ccccc3)C2)c(F)c1 ZINC000610476399 1022820394 /nfs/dbraw/zinc/82/03/94/1022820394.db2.gz LMZFRRQQHSLDKO-QGZVFWFLSA-N 1 1 332.400 4.024 20 5 EIBDMO CCSc1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)ccn1 ZINC000189581202 1023064557 /nfs/dbraw/zinc/06/45/57/1023064557.db2.gz CXEDXBHTCJZGKO-UHFFFAOYSA-N 1 1 337.832 4.045 20 5 EIBDMO CCC[C@@H]([NH2+]Cc1cn2c(cccc2C)n1)c1cccc([N+](=O)[O-])c1 ZINC000178059383 1023358737 /nfs/dbraw/zinc/35/87/37/1023358737.db2.gz BHPXHJUCAUQJLD-GOSISDBHSA-N 1 1 338.411 4.182 20 5 EIBDMO CC(=O)Nc1ccc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000781915585 1023578545 /nfs/dbraw/zinc/57/85/45/1023578545.db2.gz YXUUYZJEIBYQJO-NSHDSACASA-N 1 1 347.802 4.057 20 5 EIBDMO C[C@]1([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CCOc2ccccc21 ZINC000933372657 1023597804 /nfs/dbraw/zinc/59/78/04/1023597804.db2.gz VOHRAVDIRIIIDU-KRWDZBQOSA-N 1 1 332.787 4.036 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H]1CCOc2c(F)cccc21 ZINC000893895435 1033158255 /nfs/dbraw/zinc/15/82/55/1033158255.db2.gz DQRLDLNOWWXQDW-CQSZACIVSA-N 1 1 336.750 4.001 20 5 EIBDMO Cc1c([C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cnn1C(C)(C)C ZINC000276581476 1023767415 /nfs/dbraw/zinc/76/74/15/1023767415.db2.gz VDMFOSMZBOLALY-CHWSQXEVSA-N 1 1 330.432 4.267 20 5 EIBDMO C[C@H]1C[C@]1([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc(Cl)cc1 ZINC000500395337 1023784821 /nfs/dbraw/zinc/78/48/21/1023784821.db2.gz GUEVSYMQQOCZEI-APPDUMDISA-N 1 1 334.778 4.412 20 5 EIBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1Br ZINC000108105861 1023994543 /nfs/dbraw/zinc/99/45/43/1023994543.db2.gz CVYSRHHLCXUPOW-UHFFFAOYSA-N 1 1 349.228 4.032 20 5 EIBDMO Cc1ccc(C[C@@H](C)[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000610582219 1024132530 /nfs/dbraw/zinc/13/25/30/1024132530.db2.gz KNVRMVZSYZBNHT-CQSZACIVSA-N 1 1 339.395 4.107 20 5 EIBDMO C[NH+](C)[C@H](CNc1ccsc1[N+](=O)[O-])c1ccccc1Cl ZINC000063256258 1024210966 /nfs/dbraw/zinc/21/09/66/1024210966.db2.gz BXODMGMAMIZXBE-CYBMUJFWSA-N 1 1 325.821 4.025 20 5 EIBDMO Cc1nc2ccc(C[N@@H+](C)CCc3cccc([N+](=O)[O-])c3)cc2s1 ZINC000549805016 1033231333 /nfs/dbraw/zinc/23/13/33/1033231333.db2.gz BPBBAJVSVBDBOM-UHFFFAOYSA-N 1 1 341.436 4.187 20 5 EIBDMO CC[C@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1cccc([N+](=O)[O-])c1 ZINC000610831157 1025051392 /nfs/dbraw/zinc/05/13/92/1025051392.db2.gz DCOSUTXMQOZTAI-JKSUJKDBSA-N 1 1 332.787 4.423 20 5 EIBDMO O=[N+]([O-])c1cc(F)ccc1NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000065202220 1025150473 /nfs/dbraw/zinc/15/04/73/1025150473.db2.gz HUGPAMQCTVZINQ-MRXNPFEDSA-N 1 1 343.402 4.058 20 5 EIBDMO Cc1cccnc1[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])C(C)(C)C ZINC000934285995 1026157155 /nfs/dbraw/zinc/15/71/55/1026157155.db2.gz CIVQZZBKPNSRBG-QGZVFWFLSA-N 1 1 331.391 4.314 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](c3nccs3)C2)c(Cl)c1 ZINC000182106896 1026264581 /nfs/dbraw/zinc/26/45/81/1026264581.db2.gz OVJLSKXMVHMPML-LBPRGKRZSA-N 1 1 337.832 4.084 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3nccs3)C2)c(Cl)c1 ZINC000182106896 1026264590 /nfs/dbraw/zinc/26/45/90/1026264590.db2.gz OVJLSKXMVHMPML-LBPRGKRZSA-N 1 1 337.832 4.084 20 5 EIBDMO Cc1cc(C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc2cccnc12 ZINC000582446068 1026646975 /nfs/dbraw/zinc/64/69/75/1026646975.db2.gz XXDPZWFAOYYLBJ-UHFFFAOYSA-N 1 1 333.391 4.010 20 5 EIBDMO Cc1cc(C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc2cccnc12 ZINC000582446068 1026646981 /nfs/dbraw/zinc/64/69/81/1026646981.db2.gz XXDPZWFAOYYLBJ-UHFFFAOYSA-N 1 1 333.391 4.010 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+](CC1=Cc2ccccc2OC1)C1CC1 ZINC000507167285 1026682910 /nfs/dbraw/zinc/68/29/10/1026682910.db2.gz KZNVGXMNEZKTIJ-UHFFFAOYSA-N 1 1 336.391 4.035 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CC1=Cc2ccccc2OC1)C1CC1 ZINC000507167285 1026682917 /nfs/dbraw/zinc/68/29/17/1026682917.db2.gz KZNVGXMNEZKTIJ-UHFFFAOYSA-N 1 1 336.391 4.035 20 5 EIBDMO CCCC[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CC1 ZINC000507246404 1026721970 /nfs/dbraw/zinc/72/19/70/1026721970.db2.gz IUNNSFHARXLKGO-UHFFFAOYSA-N 1 1 331.441 4.483 20 5 EIBDMO C[C@H](c1cccs1)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000507431967 1026792660 /nfs/dbraw/zinc/79/26/60/1026792660.db2.gz GXLBJMXGXDDFRN-SNVBAGLBSA-N 1 1 342.367 4.451 20 5 EIBDMO C[C@H](c1cccs1)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000507431967 1026792678 /nfs/dbraw/zinc/79/26/78/1026792678.db2.gz GXLBJMXGXDDFRN-SNVBAGLBSA-N 1 1 342.367 4.451 20 5 EIBDMO COc1cc(C[NH2+][C@@H](C)c2cc3ccccc3o2)c([N+](=O)[O-])cc1F ZINC000184406375 1026953706 /nfs/dbraw/zinc/95/37/06/1026953706.db2.gz FPMGOPIFFWBZKJ-NSHDSACASA-N 1 1 344.342 4.340 20 5 EIBDMO CC[N@@H+](Cc1ccc(Cl)cc1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000519908209 1027039876 /nfs/dbraw/zinc/03/98/76/1027039876.db2.gz MATFIMHPERHCKH-UHFFFAOYSA-N 1 1 334.803 4.279 20 5 EIBDMO COc1ccc(C[N@H+]2C[C@@H](C)C[C@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000441353282 1027472263 /nfs/dbraw/zinc/47/22/63/1027472263.db2.gz YZIQWHZVAXRTHY-GUYCJALGSA-N 1 1 344.386 4.326 20 5 EIBDMO CC1CCC([N@H+](Cc2cccc([N+](=O)[O-])c2)C[C@@H]2CCCO2)CC1 ZINC000441431183 1027847593 /nfs/dbraw/zinc/84/75/93/1027847593.db2.gz CIXQFEFSZDJCPE-KVWWFHCMSA-N 1 1 332.444 4.155 20 5 EIBDMO CC[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H]1CCCC[C@@H]1C ZINC000444666403 1027947617 /nfs/dbraw/zinc/94/76/17/1027947617.db2.gz SHUNGKQTCMAHEO-XJKSGUPXSA-N 1 1 344.415 4.045 20 5 EIBDMO C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cc2ccccc2o1 ZINC000444669314 1027951560 /nfs/dbraw/zinc/95/15/60/1027951560.db2.gz FAVZCERWXWKUBX-LLVKDONJSA-N 1 1 336.351 4.068 20 5 EIBDMO C[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C1CCCCCC1 ZINC000536322386 1027957893 /nfs/dbraw/zinc/95/78/93/1027957893.db2.gz XMUHUZMXBNBZNT-UHFFFAOYSA-N 1 1 329.400 4.404 20 5 EIBDMO C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cc2ccccc2o1 ZINC000444680351 1027963373 /nfs/dbraw/zinc/96/33/73/1027963373.db2.gz FAVZCERWXWKUBX-NSHDSACASA-N 1 1 336.351 4.068 20 5 EIBDMO CC1CCC([N@H+](Cc2ccccc2[N+](=O)[O-])C[C@@H]2CCCO2)CC1 ZINC000441456052 1028030881 /nfs/dbraw/zinc/03/08/81/1028030881.db2.gz FPBPDHZWXAXLJI-VJFUWPCTSA-N 1 1 332.444 4.155 20 5 EIBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H](C)Cc1ccc(OC)cc1 ZINC000524425760 1028956821 /nfs/dbraw/zinc/95/68/21/1028956821.db2.gz QNHRSXBPBBXLLD-MRXNPFEDSA-N 1 1 342.439 4.099 20 5 EIBDMO Cc1c(C[N@@H+]2CCC[C@H]2c2cccc(N(C)C)c2)cccc1[N+](=O)[O-] ZINC000524755987 1029206452 /nfs/dbraw/zinc/20/64/52/1029206452.db2.gz FLOBTYSKUANYRX-FQEVSTJZSA-N 1 1 339.439 4.306 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3ccccn3)CC2)c(Cl)c1 ZINC000611792721 1029284141 /nfs/dbraw/zinc/28/41/41/1029284141.db2.gz NTEKBDXVOFZXFU-UHFFFAOYSA-N 1 1 331.803 4.023 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(OCC3CCCCC3)CC2)cs1 ZINC000525785533 1030018912 /nfs/dbraw/zinc/01/89/12/1030018912.db2.gz KHEJFCBCZLUYIA-UHFFFAOYSA-N 1 1 338.473 4.218 20 5 EIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@@H](c2ccncc2)C1 ZINC000451006864 1030174931 /nfs/dbraw/zinc/17/49/31/1030174931.db2.gz SJEUVWYFMSMGCQ-CQSZACIVSA-N 1 1 331.803 4.023 20 5 EIBDMO CC(C)([NH2+]Cc1ccccc1OC1CC1)c1ccccc1[N+](=O)[O-] ZINC000451051518 1030206597 /nfs/dbraw/zinc/20/65/97/1030206597.db2.gz BVXMANKUMWEZLF-UHFFFAOYSA-N 1 1 326.396 4.161 20 5 EIBDMO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000026475219 1030309110 /nfs/dbraw/zinc/30/91/10/1030309110.db2.gz VKBCPEYSBFCXMJ-QRWLVFNGSA-N 1 1 333.391 4.430 20 5 EIBDMO COc1ccc(C[NH2+]C2(c3ccc(F)cc3F)CCC2)cc1[N+](=O)[O-] ZINC000136134824 1030541836 /nfs/dbraw/zinc/54/18/36/1030541836.db2.gz MLYLENNFJPMTEW-UHFFFAOYSA-N 1 1 348.349 4.051 20 5 EIBDMO CC(C)[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC(C)(C)C1 ZINC000452104628 1030843698 /nfs/dbraw/zinc/84/36/98/1030843698.db2.gz MGDPINQIOSZDDU-UHFFFAOYSA-N 1 1 344.415 4.044 20 5 EIBDMO Cc1ncc(C[N@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)s1 ZINC000179382661 1031038440 /nfs/dbraw/zinc/03/84/40/1031038440.db2.gz IBZHURCMHAUDSU-UHFFFAOYSA-N 1 1 343.408 4.252 20 5 EIBDMO Cc1ncc(C[N@@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)s1 ZINC000179382661 1031038469 /nfs/dbraw/zinc/03/84/69/1031038469.db2.gz IBZHURCMHAUDSU-UHFFFAOYSA-N 1 1 343.408 4.252 20 5 EIBDMO CC[C@@H](c1ccccc1)[N@@H+](CC)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000532503270 1031224204 /nfs/dbraw/zinc/22/42/04/1031224204.db2.gz BJPLQOOBXCQRDY-KRWDZBQOSA-N 1 1 341.411 4.007 20 5 EIBDMO C[C@H]([NH2+]Cc1nc2c(s1)C[C@@H](C)CC2)c1ccc([N+](=O)[O-])cc1 ZINC000449347835 1031645569 /nfs/dbraw/zinc/64/55/69/1031645569.db2.gz JGTNMHNMIKWWNK-RYUDHWBXSA-N 1 1 331.441 4.027 20 5 EIBDMO CCO[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H]1C ZINC000449504078 1031812645 /nfs/dbraw/zinc/81/26/45/1031812645.db2.gz YHONJTLLMREVCT-KSSFIOAISA-N 1 1 344.411 4.102 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cc4cccnc4o3)C2)cc1 ZINC000449503195 1031812880 /nfs/dbraw/zinc/81/28/80/1031812880.db2.gz SZQPCFPVYODUNZ-INIZCTEOSA-N 1 1 337.379 4.116 20 5 EIBDMO Cc1ccc(C[NH2+][C@H]2CCc3cc(F)c(F)c(F)c32)cc1[N+](=O)[O-] ZINC000449587290 1031864757 /nfs/dbraw/zinc/86/47/57/1031864757.db2.gz OHHZOVGOTAEYPX-ZDUSSCGKSA-N 1 1 336.313 4.098 20 5 EIBDMO C[C@@H]1CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H]1C ZINC000512643512 1033599930 /nfs/dbraw/zinc/59/99/30/1033599930.db2.gz DMZRZZMACMCFLU-CHWSQXEVSA-N 1 1 331.441 4.339 20 5 EIBDMO Cc1ccc(C[NH+]2CCC(c3ncccc3Cl)CC2)cc1[N+](=O)[O-] ZINC000433035076 1033712399 /nfs/dbraw/zinc/71/23/99/1033712399.db2.gz KNOGQXNFLKLKGZ-UHFFFAOYSA-N 1 1 345.830 4.331 20 5 EIBDMO COc1cc(C[N@@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)ccc1SC ZINC000512697198 1033718089 /nfs/dbraw/zinc/71/80/89/1033718089.db2.gz ONRKGISAXUHTLI-UHFFFAOYSA-N 1 1 346.452 4.266 20 5 EIBDMO Cc1csc([C@@H](C)[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)n1 ZINC000433169661 1033975215 /nfs/dbraw/zinc/97/52/15/1033975215.db2.gz YBOMYEYUXVCOSC-IAQYHMDHSA-N 1 1 331.441 4.433 20 5 EIBDMO C[NH+](C)[C@H](CNc1ccc([N+](=O)[O-])cc1F)c1ccccc1Cl ZINC000513084949 1034506794 /nfs/dbraw/zinc/50/67/94/1034506794.db2.gz XGRQKECGOIYPSL-MRXNPFEDSA-N 1 1 337.782 4.102 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCN(c2ccccc2F)CC1 ZINC000513360363 1034892481 /nfs/dbraw/zinc/89/24/81/1034892481.db2.gz AIOINHQTFFGOKQ-OAHLLOKOSA-N 1 1 343.402 4.007 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1cnccc1C(C)(C)C ZINC000595043933 1035567686 /nfs/dbraw/zinc/56/76/86/1035567686.db2.gz BPUXZNQQKABBEC-CYBMUJFWSA-N 1 1 343.427 4.147 20 5 EIBDMO Cc1noc(C[N@H+]2CC=C(c3cccc4ccccc43)CC2)c1[N+](=O)[O-] ZINC000595296761 1035625764 /nfs/dbraw/zinc/62/57/64/1035625764.db2.gz JEHMEKVJCZXZKV-UHFFFAOYSA-N 1 1 349.390 4.334 20 5 EIBDMO Cc1noc(C[N@@H+]2CC=C(c3cccc4ccccc43)CC2)c1[N+](=O)[O-] ZINC000595296761 1035625787 /nfs/dbraw/zinc/62/57/87/1035625787.db2.gz JEHMEKVJCZXZKV-UHFFFAOYSA-N 1 1 349.390 4.334 20 5 EIBDMO O=[N+]([O-])c1cc(F)ccc1C[NH+]1CCC(OC2CCCCC2)CC1 ZINC000595299421 1035626253 /nfs/dbraw/zinc/62/62/53/1035626253.db2.gz ZCWIWPQCDJOWNU-UHFFFAOYSA-N 1 1 336.407 4.048 20 5 EIBDMO Cc1noc(C[N@@H+]2CCCC[C@@H]2c2cccc(C)c2C)c1[N+](=O)[O-] ZINC000595330018 1035632285 /nfs/dbraw/zinc/63/22/85/1035632285.db2.gz GTZIGGCWAYTSMQ-MRXNPFEDSA-N 1 1 329.400 4.235 20 5 EIBDMO Cc1noc(C[N@H+]2CCCC[C@@H]2c2cccc(C)c2C)c1[N+](=O)[O-] ZINC000595330018 1035632292 /nfs/dbraw/zinc/63/22/92/1035632292.db2.gz GTZIGGCWAYTSMQ-MRXNPFEDSA-N 1 1 329.400 4.235 20 5 EIBDMO CC(C)Oc1ccccc1[C@H](C)[NH2+]Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595416532 1035673688 /nfs/dbraw/zinc/67/36/88/1035673688.db2.gz QRIOGHHKURUFMC-ZDUSSCGKSA-N 1 1 332.375 4.372 20 5 EIBDMO Cc1noc(C[NH2+][C@H](CC(C)(C)C)c2ccc(F)cc2)c1[N+](=O)[O-] ZINC000595412008 1035674106 /nfs/dbraw/zinc/67/41/06/1035674106.db2.gz KDPALAAHVMTWRF-CQSZACIVSA-N 1 1 335.379 4.297 20 5 EIBDMO C[N@H+](Cc1ccc(OC(F)(F)F)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000501847622 1035674043 /nfs/dbraw/zinc/67/40/43/1035674043.db2.gz GDQHLHOFPBKTOG-UHFFFAOYSA-N 1 1 340.301 4.125 20 5 EIBDMO C[N@@H+](Cc1ccc(OC(F)(F)F)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000501847622 1035674051 /nfs/dbraw/zinc/67/40/51/1035674051.db2.gz GDQHLHOFPBKTOG-UHFFFAOYSA-N 1 1 340.301 4.125 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccc(OC(F)F)c2)C2CC2)cc1 ZINC000490830719 1035676365 /nfs/dbraw/zinc/67/63/65/1035676365.db2.gz XDUMDNDFBLJAGB-UHFFFAOYSA-N 1 1 348.349 4.361 20 5 EIBDMO Cc1noc(C[N@H+](C)[C@@H]2CCCC[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000595548487 1035702043 /nfs/dbraw/zinc/70/20/43/1035702043.db2.gz SNUMZCUFWUORBN-JKSUJKDBSA-N 1 1 329.400 4.049 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC([C@H]2CCCCO2)CC1 ZINC000595789269 1035791891 /nfs/dbraw/zinc/79/18/91/1035791891.db2.gz QDNPUMKVLIVCHL-QGZVFWFLSA-N 1 1 338.835 4.029 20 5 EIBDMO CC[C@@H](C)[N@@H+](C)CCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491050209 1035792506 /nfs/dbraw/zinc/79/25/06/1035792506.db2.gz GZXUAQCZSXGTHL-UZLBHIALSA-N 1 1 341.455 4.004 20 5 EIBDMO COc1cccc([C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC000491091120 1035805873 /nfs/dbraw/zinc/80/58/73/1035805873.db2.gz NWFKMVIHIMYPKH-GOSISDBHSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1cccc([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC000491091120 1035805878 /nfs/dbraw/zinc/80/58/78/1035805878.db2.gz NWFKMVIHIMYPKH-GOSISDBHSA-N 1 1 330.359 4.080 20 5 EIBDMO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H](C)c1cccc(OC)c1 ZINC000491164578 1035820173 /nfs/dbraw/zinc/82/01/73/1035820173.db2.gz AVMLVOVWWYKSFF-ZDUSSCGKSA-N 1 1 332.375 4.326 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H](C)c1cccc(OC)c1 ZINC000491164578 1035820175 /nfs/dbraw/zinc/82/01/75/1035820175.db2.gz AVMLVOVWWYKSFF-ZDUSSCGKSA-N 1 1 332.375 4.326 20 5 EIBDMO C[C@H]([NH2+][C@H]1CCc2ccccc2-n2ccnc21)c1ccc([N+](=O)[O-])cc1 ZINC000596094001 1035821133 /nfs/dbraw/zinc/82/11/33/1035821133.db2.gz FZLRPAXRISVVGU-KSSFIOAISA-N 1 1 348.406 4.119 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000596590299 1035910335 /nfs/dbraw/zinc/91/03/35/1035910335.db2.gz CMAVGXKFAOEDEJ-KSSFIOAISA-N 1 1 325.412 4.442 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000596590299 1035910384 /nfs/dbraw/zinc/91/03/84/1035910384.db2.gz CMAVGXKFAOEDEJ-KSSFIOAISA-N 1 1 325.412 4.442 20 5 EIBDMO CC(C)[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccsc1 ZINC000421008283 1035944590 /nfs/dbraw/zinc/94/45/90/1035944590.db2.gz LWMGEJVXEBRWBT-ZDUSSCGKSA-N 1 1 347.440 4.066 20 5 EIBDMO CC(C)[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccsc1 ZINC000421008283 1035944606 /nfs/dbraw/zinc/94/46/06/1035944606.db2.gz LWMGEJVXEBRWBT-ZDUSSCGKSA-N 1 1 347.440 4.066 20 5 EIBDMO C[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc2ncsc2c1 ZINC000485803181 1036282112 /nfs/dbraw/zinc/28/21/12/1036282112.db2.gz NPMTXLKNENHDTP-JTQLQIEISA-N 1 1 331.372 4.194 20 5 EIBDMO Cc1ccccc1C1([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CCC1 ZINC000602699952 1036578641 /nfs/dbraw/zinc/57/86/41/1036578641.db2.gz PUCXUCZFTIFGOJ-UHFFFAOYSA-N 1 1 337.379 4.213 20 5 EIBDMO COc1ccc(C[N@H+](Cc2csc([N+](=O)[O-])c2)C(C)(C)C)cc1 ZINC000588985151 1036632806 /nfs/dbraw/zinc/63/28/06/1036632806.db2.gz ZGOCPVVOCPRMRO-UHFFFAOYSA-N 1 1 334.441 4.466 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2csc([N+](=O)[O-])c2)C(C)(C)C)cc1 ZINC000588985151 1036632819 /nfs/dbraw/zinc/63/28/19/1036632819.db2.gz ZGOCPVVOCPRMRO-UHFFFAOYSA-N 1 1 334.441 4.466 20 5 EIBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCC1(F)F ZINC000589520351 1036821146 /nfs/dbraw/zinc/82/11/46/1036821146.db2.gz ACYASIMANICELQ-LBPRGKRZSA-N 1 1 336.338 4.332 20 5 EIBDMO CCC[N@@H+](Cc1ccc(C)cc1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000603838309 1037021478 /nfs/dbraw/zinc/02/14/78/1037021478.db2.gz CVZBQNNACFMKMX-UHFFFAOYSA-N 1 1 328.412 4.324 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2cc(F)cc(F)c2)cc(C(F)(F)F)c1 ZINC000487192484 1037040234 /nfs/dbraw/zinc/04/02/34/1037040234.db2.gz XRJGSNQSOVOCSP-UHFFFAOYSA-N 1 1 346.255 4.182 20 5 EIBDMO COc1ccccc1C[N@H+](Cc1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000603857813 1037050829 /nfs/dbraw/zinc/05/08/29/1037050829.db2.gz SXNLQXDBBQEGTO-UHFFFAOYSA-N 1 1 326.396 4.076 20 5 EIBDMO COc1ccccc1C[N@@H+](Cc1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000603857813 1037050848 /nfs/dbraw/zinc/05/08/48/1037050848.db2.gz SXNLQXDBBQEGTO-UHFFFAOYSA-N 1 1 326.396 4.076 20 5 EIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000603840450 1037056787 /nfs/dbraw/zinc/05/67/87/1037056787.db2.gz DZKIBMJDEIMIBA-MRXNPFEDSA-N 1 1 346.814 4.464 20 5 EIBDMO C[NH+](C)[C@@H](CNc1ccsc1[N+](=O)[O-])c1ccccc1Cl ZINC000604433313 1037388271 /nfs/dbraw/zinc/38/82/71/1037388271.db2.gz BXODMGMAMIZXBE-ZDUSSCGKSA-N 1 1 325.821 4.025 20 5 EIBDMO COc1cc(C[NH2+]C2(c3ccccc3F)CCC2)c([N+](=O)[O-])cc1F ZINC000592144223 1037748690 /nfs/dbraw/zinc/74/86/90/1037748690.db2.gz FBGFVWQATXTMAE-UHFFFAOYSA-N 1 1 348.349 4.051 20 5 EIBDMO CC[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCCC[C@H]1C ZINC000249397312 1037795820 /nfs/dbraw/zinc/79/58/20/1037795820.db2.gz RYZGCZHFJPZFCR-CJNGLKHVSA-N 1 1 344.415 4.045 20 5 EIBDMO Cc1cc(NCc2csc([N+](=O)[O-])c2)c[nH+]c1N1CCCC[C@@H]1C ZINC000503954272 1038047801 /nfs/dbraw/zinc/04/78/01/1038047801.db2.gz XXBVUTBSRPALJC-ZDUSSCGKSA-N 1 1 346.456 4.351 20 5 EIBDMO COc1ccccc1[C@H]1CC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000490034219 1038309817 /nfs/dbraw/zinc/30/98/17/1038309817.db2.gz UQIDPZIJPIELFS-CVEARBPZSA-N 1 1 340.423 4.462 20 5 EIBDMO Cc1ccc(C[N@H+](CCOc2ccccc2[N+](=O)[O-])C(C)C)s1 ZINC000065162299 1038895328 /nfs/dbraw/zinc/89/53/28/1038895328.db2.gz VJLXZVGSNBBZDU-UHFFFAOYSA-N 1 1 334.441 4.254 20 5 EIBDMO C[N@H+]1CC[C@@H](Nc2ccc3ncccc3c2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000534270575 1039282478 /nfs/dbraw/zinc/28/24/78/1039282478.db2.gz BFTGSCCJZZWCRJ-MOPGFXCFSA-N 1 1 348.406 4.000 20 5 EIBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCCCC[C@@H]2c2ccc(Cl)cc2)n1 ZINC000478051595 1039373117 /nfs/dbraw/zinc/37/31/17/1039373117.db2.gz BVGXBLDWRNOIGP-MRXNPFEDSA-N 1 1 348.834 4.062 20 5 EIBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCCc2cccnc21 ZINC000481416568 1039404646 /nfs/dbraw/zinc/40/46/46/1039404646.db2.gz PWSJHUPFLNVUFT-SFHVURJKSA-N 1 1 325.412 4.279 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1C ZINC000535072217 1039940322 /nfs/dbraw/zinc/94/03/22/1039940322.db2.gz KAKBCKSBCPMRKL-UHFFFAOYSA-N 1 1 326.396 4.076 20 5 EIBDMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000482497108 1040293737 /nfs/dbraw/zinc/29/37/37/1040293737.db2.gz YMCYORPMORZZDG-LRDDRELGSA-N 1 1 331.441 4.339 20 5 EIBDMO C[C@@H]([NH2+]CC(C)(C)N[C@@H](C)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000482955519 1040602963 /nfs/dbraw/zinc/60/29/63/1040602963.db2.gz ZZAYZEOSRTVQAB-CVEARBPZSA-N 1 1 341.455 4.375 20 5 EIBDMO C[C@@H](c1ccsc1)[NH+]1CCN([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000462446915 1040612401 /nfs/dbraw/zinc/61/24/01/1040612401.db2.gz LZNLTRXTBZFQRC-GJZGRUSLSA-N 1 1 345.468 4.096 20 5 EIBDMO C[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCC(C)(C)C1 ZINC000483114249 1040710259 /nfs/dbraw/zinc/71/02/59/1040710259.db2.gz WIHZIIWYGVYUNT-MRXNPFEDSA-N 1 1 329.400 4.260 20 5 EIBDMO CC(C)[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@@H]1CCOC1 ZINC000462878067 1041059117 /nfs/dbraw/zinc/05/91/17/1041059117.db2.gz QIDSZRYPWWSXTO-MRXNPFEDSA-N 1 1 346.452 4.323 20 5 EIBDMO CC(C)c1ccccc1NC(=O)C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000538227323 1041188154 /nfs/dbraw/zinc/18/81/54/1041188154.db2.gz ONQYAAALTGOMEH-AWEZNQCLSA-N 1 1 341.411 4.008 20 5 EIBDMO Cc1cc(N2CC[C@@H](C)[N@H+](Cc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000463071161 1041315586 /nfs/dbraw/zinc/31/55/86/1041315586.db2.gz VXGZXICIGNUXMF-QGZVFWFLSA-N 1 1 339.439 4.004 20 5 EIBDMO C[C@H](Nc1cccc(CC[N@@H+](C)C2CC2)c1)c1ccccc1[N+](=O)[O-] ZINC000540337974 1041381171 /nfs/dbraw/zinc/38/11/71/1041381171.db2.gz NKPMZZNOWKBXOQ-HNNXBMFYSA-N 1 1 339.439 4.405 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](COc2ccccc2)C1 ZINC000505861281 1041425734 /nfs/dbraw/zinc/42/57/34/1041425734.db2.gz CHCRBDYMLUBPEL-CVEARBPZSA-N 1 1 326.396 4.057 20 5 EIBDMO Cc1c(C[N@H+]2CC[C@H](C(F)(F)F)C3(CCC3)C2)cccc1[N+](=O)[O-] ZINC000554845544 1041443848 /nfs/dbraw/zinc/44/38/48/1041443848.db2.gz BISHBVHRYHADKO-HNNXBMFYSA-N 1 1 342.361 4.458 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](C(F)(F)F)C3(CCC3)C2)cc1 ZINC000554846065 1041445456 /nfs/dbraw/zinc/44/54/56/1041445456.db2.gz JLOCUNUTMHACGC-AWEZNQCLSA-N 1 1 328.334 4.149 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](COc2ccccc2)C1 ZINC000505880240 1041475627 /nfs/dbraw/zinc/47/56/27/1041475627.db2.gz RLNRIGYVHQZZCO-JKSUJKDBSA-N 1 1 326.396 4.057 20 5 EIBDMO C[C@@H]1CCC[C@H](C)[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000538726798 1041498692 /nfs/dbraw/zinc/49/86/92/1041498692.db2.gz YJQCWHAHASNPTR-CABCVRRESA-N 1 1 342.443 4.006 20 5 EIBDMO CCC[C@@H]1CCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000538752064 1041528452 /nfs/dbraw/zinc/52/84/52/1041528452.db2.gz GNLYGXDRXRIFOW-OAHLLOKOSA-N 1 1 342.443 4.007 20 5 EIBDMO CC(C)COC[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1ccco1 ZINC000540596657 1041552668 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333.476 4.146 20 5 EIBDMO CCC[C@@H](NC[C@@H]1CCC[N@H+](C(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000125868559 1045063447 /nfs/dbraw/zinc/06/34/47/1045063447.db2.gz JAKAEPBKCGJXHA-QFBILLFUSA-N 1 1 333.476 4.146 20 5 EIBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H](CCOC)c2ccco2)cc1[N+](=O)[O-] ZINC000272487859 1045491823 /nfs/dbraw/zinc/49/18/23/1045491823.db2.gz BXEPPBCZFDCEQQ-HIFRSBDPSA-N 1 1 348.399 4.015 20 5 EIBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H]1CCOc2ccccc21 ZINC000768214496 1045753927 /nfs/dbraw/zinc/75/39/27/1045753927.db2.gz BPFVAYRWMZBPSC-ZDUSSCGKSA-N 1 1 346.814 4.246 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)ccc1Cl ZINC000768549103 1045822363 /nfs/dbraw/zinc/82/23/63/1045822363.db2.gz OPIPHDRERLYUHD-DZGCQCFKSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)ccc1Cl ZINC000768549103 1045822358 /nfs/dbraw/zinc/82/23/58/1045822358.db2.gz OPIPHDRERLYUHD-DZGCQCFKSA-N 1 1 326.849 4.108 20 5 EIBDMO 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BDCLPSJVDWJVSO-QSFXBCCZSA-N 1 1 339.439 4.081 20 5 EIBDMO C[C@H](N[C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000556057310 1047420317 /nfs/dbraw/zinc/42/03/17/1047420317.db2.gz BDCLPSJVDWJVSO-QSFXBCCZSA-N 1 1 339.439 4.081 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1nc(C(C)(C)C)co1 ZINC000897944293 1047514810 /nfs/dbraw/zinc/51/48/10/1047514810.db2.gz LQNGTAPFSZBMCN-MDWZMJQESA-N 1 1 329.400 4.073 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3ccnc(Cl)c3F)C2)cc1 ZINC000824820782 1047958997 /nfs/dbraw/zinc/95/89/97/1047958997.db2.gz MTAPORNWNDPFQD-CYBMUJFWSA-N 1 1 349.793 4.162 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3ccnc(Cl)c3F)C2)cc1 ZINC000824820782 1047959013 /nfs/dbraw/zinc/95/90/13/1047959013.db2.gz MTAPORNWNDPFQD-CYBMUJFWSA-N 1 1 349.793 4.162 20 5 EIBDMO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccncc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815565820 1048511502 /nfs/dbraw/zinc/51/15/02/1048511502.db2.gz BEQRFFGYPOEBML-JLTOFOAXSA-N 1 1 348.406 4.012 20 5 EIBDMO c1nc2c([nH]1)CC[C@H]([NH2+]Cc1c3ccccc3cc3ccccc31)C2 ZINC000810171735 1048653537 /nfs/dbraw/zinc/65/35/37/1048653537.db2.gz RSPFSDWGLRYQBX-KRWDZBQOSA-N 1 1 327.431 4.363 20 5 EIBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(CNc2ncc([N+](=O)[O-])s2)cc1 ZINC000195508894 1048886389 /nfs/dbraw/zinc/88/63/89/1048886389.db2.gz BPUNYBILJHNYSM-ZDUSSCGKSA-N 1 1 346.456 4.038 20 5 EIBDMO CC(C)[N@@H+](CCOc1ccccc1F)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350425 1049051619 /nfs/dbraw/zinc/05/16/19/1049051619.db2.gz PDBSSJMFMCOMEA-UHFFFAOYSA-N 1 1 332.375 4.023 20 5 EIBDMO COc1ccc([C@@H](C)[N@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000609705219 1049275025 /nfs/dbraw/zinc/27/50/25/1049275025.db2.gz HGHYMOSUOKKYHD-GFCCVEGCSA-N 1 1 334.803 4.450 20 5 EIBDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000609705219 1049275044 /nfs/dbraw/zinc/27/50/44/1049275044.db2.gz HGHYMOSUOKKYHD-GFCCVEGCSA-N 1 1 334.803 4.450 20 5 EIBDMO O=[N+]([O-])c1ccc(NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)c(F)c1 ZINC000064550847 1049338119 /nfs/dbraw/zinc/33/81/19/1049338119.db2.gz ZRIVBQSQPUNCQB-CYBMUJFWSA-N 1 1 349.431 4.120 20 5 EIBDMO Cc1c(C[N@@H+]2C[C@@H](c3ccc(F)cc3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000609916539 1049393429 /nfs/dbraw/zinc/39/34/29/1049393429.db2.gz WOKHAKDQRYAPKR-DYVFJYSZSA-N 1 1 328.387 4.420 20 5 EIBDMO COc1ccccc1[C@@H]1CC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000610004211 1049477992 /nfs/dbraw/zinc/47/79/92/1049477992.db2.gz FTCHWZFRDANJAW-GDBMZVCRSA-N 1 1 326.396 4.154 20 5 EIBDMO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000610091400 1049535037 /nfs/dbraw/zinc/53/50/37/1049535037.db2.gz QJKSUWDVIURUTR-CZUORRHYSA-N 1 1 344.415 4.045 20 5 EIBDMO Cc1c([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)cccc1[N+](=O)[O-] ZINC000773037282 1049543809 /nfs/dbraw/zinc/54/38/09/1049543809.db2.gz SDUIOYAOLZAVGT-LLVKDONJSA-N 1 1 349.774 4.316 20 5 EIBDMO CC(C)Oc1cccc([C@@H](C)[NH2+]Cc2cc(F)ccc2[N+](=O)[O-])c1 ZINC000179668348 1049716686 /nfs/dbraw/zinc/71/66/86/1049716686.db2.gz SKNAGRHEGCJXRK-CYBMUJFWSA-N 1 1 332.375 4.372 20 5 EIBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[C@H]1c1ccccc1 ZINC001171018507 1049852232 /nfs/dbraw/zinc/85/22/32/1049852232.db2.gz PXPINNOUMNDEAI-PMACEKPBSA-N 1 1 340.423 4.242 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCc3cc(F)ccc3C1)CC2 ZINC001172919138 1050234579 /nfs/dbraw/zinc/23/45/79/1050234579.db2.gz DZVNQLNEECDRSC-IBGZPJMESA-N 1 1 340.398 4.040 20 5 EIBDMO C[C@H]1CC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCC1(F)F ZINC001172909690 1050244726 /nfs/dbraw/zinc/24/47/26/1050244726.db2.gz UXVIGGXOISIIPS-BBRMVZONSA-N 1 1 338.398 4.209 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCSC[C@H]1c1ccccc1 ZINC001173228400 1050357338 /nfs/dbraw/zinc/35/73/38/1050357338.db2.gz VWJRYGBONXNMDD-KXBFYZLASA-N 1 1 342.464 4.316 20 5 EIBDMO CC[N@@H+](CCc1ccc(OC)cc1)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173233812 1050361965 /nfs/dbraw/zinc/36/19/65/1050361965.db2.gz ZAADQRUIEKWJSL-INIZCTEOSA-N 1 1 342.439 4.099 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]Cc3cccc(F)c3F)o2)c1 ZINC001179291437 1050664700 /nfs/dbraw/zinc/66/47/00/1050664700.db2.gz OBQQIUOEYKHCEU-UHFFFAOYSA-N 1 1 344.317 4.423 20 5 EIBDMO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C)c1c(C)noc1C ZINC000182458243 1050670805 /nfs/dbraw/zinc/67/08/05/1050670805.db2.gz SPZSBFSIEYMEFM-MRXNPFEDSA-N 1 1 347.415 4.228 20 5 EIBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)c1ccc[nH]1 ZINC001188573908 1050807937 /nfs/dbraw/zinc/80/79/37/1050807937.db2.gz FIHHMLIGPCKVDQ-UHFFFAOYSA-N 1 1 344.418 4.343 20 5 EIBDMO Nc1ccc2cc3ccc(Nc4ccc5nccn5c4)cc3[nH+]c2c1 ZINC001174277590 1050877529 /nfs/dbraw/zinc/87/75/29/1050877529.db2.gz HNJILURAEURSPW-UHFFFAOYSA-N 1 1 325.375 4.362 20 5 EIBDMO Cc1ccc([C@@H](C)[N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC001190366647 1051171283 /nfs/dbraw/zinc/17/12/83/1051171283.db2.gz SJURLSDNWNJKRF-MRXNPFEDSA-N 1 1 328.412 4.365 20 5 EIBDMO CCCCC[C@H]1CCCC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC001174780331 1051172358 /nfs/dbraw/zinc/17/23/58/1051172358.db2.gz OVFXZKULBCUVQE-INIZCTEOSA-N 1 1 347.459 4.277 20 5 EIBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC3CC2(C)C3)cc1OC ZINC001174799016 1051196307 /nfs/dbraw/zinc/19/63/07/1051196307.db2.gz QVJOXGJMOXCSDO-CDJWAVJASA-N 1 1 348.443 4.013 20 5 EIBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CC3CC2(C)C3)cc1OC ZINC001174799016 1051196312 /nfs/dbraw/zinc/19/63/12/1051196312.db2.gz QVJOXGJMOXCSDO-CDJWAVJASA-N 1 1 348.443 4.013 20 5 EIBDMO COc1cc(C[N@H+]2CCC[C@H](C(C)(C)C)CC2)c([N+](=O)[O-])cc1F ZINC001191021956 1051327874 /nfs/dbraw/zinc/32/78/74/1051327874.db2.gz MRMFKEGHBSHJKQ-AWEZNQCLSA-N 1 1 338.423 4.391 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@H](C)C[C@H]1c1cccc(F)c1 ZINC001191244096 1051408664 /nfs/dbraw/zinc/40/86/64/1051408664.db2.gz GMWNQUJETVYDFE-ACJLOTCBSA-N 1 1 344.386 4.326 20 5 EIBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CC2(CCC2)[C@H]1C1CC1 ZINC001182184369 1051415185 /nfs/dbraw/zinc/41/51/85/1051415185.db2.gz OBDUYFNTRYNXBG-OAHLLOKOSA-N 1 1 340.345 4.378 20 5 EIBDMO COc1cc(C[NH+]2CCC(CCC(C)C)CC2)c([N+](=O)[O-])cc1F ZINC001191610656 1051500893 /nfs/dbraw/zinc/50/08/93/1051500893.db2.gz OLVJKFLNMYIXDN-UHFFFAOYSA-N 1 1 338.423 4.391 20 5 EIBDMO O=[N+]([O-])c1ccc(CC[N@@H+](Cc2ccccc2F)C2CCC2)cc1 ZINC001192214408 1051667378 /nfs/dbraw/zinc/66/73/78/1051667378.db2.gz OEIDVDTZYGYXJR-UHFFFAOYSA-N 1 1 328.387 4.331 20 5 EIBDMO Cc1csc([C@@H]2CC[N@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC001175946759 1051863738 /nfs/dbraw/zinc/86/37/38/1051863738.db2.gz LWKJQKPKVZFUAQ-UONOGXRCSA-N 1 1 331.441 4.219 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](c2ccc(C)cc2)C[C@H]1C ZINC001193931173 1052023012 /nfs/dbraw/zinc/02/30/12/1052023012.db2.gz MLNOFISNVQCLSF-WBVHZDCISA-N 1 1 340.423 4.290 20 5 EIBDMO CC[C@H](c1cccc(OC)c1)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC001194107647 1052076021 /nfs/dbraw/zinc/07/60/21/1052076021.db2.gz KGTDOTHZUFKDDY-LJQANCHMSA-N 1 1 344.411 4.065 20 5 EIBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H]2/C=C\c2ccccc2)cc1 ZINC001176641218 1052150564 /nfs/dbraw/zinc/15/05/64/1052150564.db2.gz QQRFPNBFCQOHIR-CNZFZVQHSA-N 1 1 338.407 4.151 20 5 EIBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001185037851 1052158862 /nfs/dbraw/zinc/15/88/62/1052158862.db2.gz XMSQSYFEEQPQTM-BBRMVZONSA-N 1 1 345.830 4.496 20 5 EIBDMO CC(C)[N@H+]1CCC[C@H](CNc2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC001185088814 1052164601 /nfs/dbraw/zinc/16/46/01/1052164601.db2.gz NZZYKDCHEIHPGC-GFCCVEGCSA-N 1 1 345.365 4.146 20 5 EIBDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001185701606 1052284550 /nfs/dbraw/zinc/28/45/50/1052284550.db2.gz LDLNOWDMHJNPGM-MRXNPFEDSA-N 1 1 331.460 4.076 20 5 EIBDMO CC[N@@H+](C[C@H](O)c1ccc(C)cc1)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000764282160 1053051928 /nfs/dbraw/zinc/05/19/28/1053051928.db2.gz CIPIAKCNYJMWRM-KXBFYZLASA-N 1 1 328.412 4.020 20 5 EIBDMO C[C@@H]1C[C@@H](C(C)(C)C)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001194807730 1053109839 /nfs/dbraw/zinc/10/98/39/1053109839.db2.gz SYHXDVPNABPRAG-CABCVRRESA-N 1 1 347.459 4.070 20 5 EIBDMO CC(C)[C@H](O)[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 ZINC000850394964 1053164590 /nfs/dbraw/zinc/16/45/90/1053164590.db2.gz KEZZEHCSVPIWFF-MSOLQXFVSA-N 1 1 348.830 4.096 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@]2(C)c2ccccc2)cc1[N+](=O)[O-] ZINC001197342691 1053879050 /nfs/dbraw/zinc/87/90/50/1053879050.db2.gz QQMMDNZFPFUYNT-LJQANCHMSA-N 1 1 326.396 4.115 20 5 EIBDMO C[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC001197660393 1053960616 /nfs/dbraw/zinc/96/06/16/1053960616.db2.gz NPUSXRYMCGQCGJ-FZKQIMNGSA-N 1 1 341.367 4.086 20 5 EIBDMO C[C@@]1(Cc2cccs2)CCC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC001198300399 1054120036 /nfs/dbraw/zinc/12/00/36/1054120036.db2.gz NBLBMTALGRITMO-KRWDZBQOSA-N 1 1 334.416 4.393 20 5 EIBDMO C[C@@H]([NH2+][C@@H](C)c1ccc(C(F)(F)F)nc1)c1ccccc1[N+](=O)[O-] ZINC000871937664 1054323706 /nfs/dbraw/zinc/32/37/06/1054323706.db2.gz XCKDIGZWTMXJTD-WDEREUQCSA-N 1 1 339.317 4.420 20 5 EIBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)c1c(C)noc1C ZINC000872035172 1054351583 /nfs/dbraw/zinc/35/15/83/1054351583.db2.gz NJRXIUJVRMTDPC-ZJUUUORDSA-N 1 1 335.429 4.333 20 5 EIBDMO CC(C)[C@@H](O)[C@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000872088755 1054384231 /nfs/dbraw/zinc/38/42/31/1054384231.db2.gz PXLBPUGDRNIMMR-MJXNMMHHSA-N 1 1 346.402 4.143 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ncc(Cl)s1)CCCC2 ZINC000872111572 1054392589 /nfs/dbraw/zinc/39/25/89/1054392589.db2.gz CAGRJLBRMVLEEH-ZDUSSCGKSA-N 1 1 337.832 4.262 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3ccc(Cl)nc3)o2)cc1 ZINC001199413850 1054408477 /nfs/dbraw/zinc/40/84/77/1054408477.db2.gz RHFPOYNHZIWHIQ-UHFFFAOYSA-N 1 1 343.770 4.193 20 5 EIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@H](OC2CCC2)CC1 ZINC000872260391 1054426979 /nfs/dbraw/zinc/42/69/79/1054426979.db2.gz OZLMWEJKQVUONL-WEBJUUICSA-N 1 1 330.428 4.032 20 5 EIBDMO CCn1c2ccccc2nc1[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000173428769 1054948242 /nfs/dbraw/zinc/94/82/42/1054948242.db2.gz QBXDHHIYXXSDRC-UONOGXRCSA-N 1 1 338.411 4.376 20 5 EIBDMO Cc1csc([C@@H]2CC[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)n1 ZINC000877813038 1055125965 /nfs/dbraw/zinc/12/59/65/1055125965.db2.gz INRUETUTOLNKHJ-LLVKDONJSA-N 1 1 337.832 4.003 20 5 EIBDMO Cc1ccc([C@@H]2CCC[N@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1C ZINC000776279941 1055150700 /nfs/dbraw/zinc/15/07/00/1055150700.db2.gz VDWYEIWJNPKUAS-PMACEKPBSA-N 1 1 340.423 4.082 20 5 EIBDMO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776280466 1055155351 /nfs/dbraw/zinc/15/53/51/1055155351.db2.gz ZXWCSKWPLMDGPT-GUYCJALGSA-N 1 1 340.379 4.067 20 5 EIBDMO C[C@H](c1cc2ccccc2o1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776280465 1055155468 /nfs/dbraw/zinc/15/54/68/1055155468.db2.gz ZXWCSKWPLMDGPT-DYVFJYSZSA-N 1 1 340.379 4.067 20 5 EIBDMO Cc1occc1C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000338926498 1055293791 /nfs/dbraw/zinc/29/37/91/1055293791.db2.gz RFZZOTIDZTWGSZ-UHFFFAOYSA-N 1 1 328.290 4.147 20 5 EIBDMO Cc1occc1C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000338926498 1055293806 /nfs/dbraw/zinc/29/38/06/1055293806.db2.gz RFZZOTIDZTWGSZ-UHFFFAOYSA-N 1 1 328.290 4.147 20 5 EIBDMO CCOc1ccc([C@@H](C)[NH2+][C@H](C)c2nc(C)cs2)cc1[N+](=O)[O-] ZINC000153546227 1055516911 /nfs/dbraw/zinc/51/69/11/1055516911.db2.gz BKOBBROKABXRMO-VXGBXAGGSA-N 1 1 335.429 4.170 20 5 EIBDMO Cc1c([C@@H](C)[NH2+][C@@H]2CCCc3cn(C(C)C)nc32)cccc1[N+](=O)[O-] ZINC000765819029 1055557117 /nfs/dbraw/zinc/55/71/17/1055557117.db2.gz PZSGXHLNCWVHHI-RHSMWYFYSA-N 1 1 342.443 4.409 20 5 EIBDMO C[C@@H]1C[C@H](Nc2cccc(F)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000301508512 1055647520 /nfs/dbraw/zinc/64/75/20/1055647520.db2.gz AQBPSVXDGNISDJ-GDBMZVCRSA-N 1 1 343.402 4.199 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCc3cn(C(C)C)nc32)cc1[N+](=O)[O-] ZINC000765825830 1055805270 /nfs/dbraw/zinc/80/52/70/1055805270.db2.gz WKRFTZYDOKVGQW-RHSMWYFYSA-N 1 1 342.443 4.409 20 5 EIBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000542697521 1055838781 /nfs/dbraw/zinc/83/87/81/1055838781.db2.gz NPFPATYWOXFOLG-IBGZPJMESA-N 1 1 326.396 4.249 20 5 EIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C1CCC(F)(F)CC1 ZINC000554311629 1056056363 /nfs/dbraw/zinc/05/63/63/1056056363.db2.gz OYKZVSKAIYBUON-UHFFFAOYSA-N 1 1 328.359 4.003 20 5 EIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](C)C(C)(C)C1 ZINC000273705709 1056088734 /nfs/dbraw/zinc/08/87/34/1056088734.db2.gz NKYVNZOFKRNXKV-QWHCGFSZSA-N 1 1 344.415 4.074 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@H+]3CCC4(CCCC4)C3)c2c1 ZINC000743389510 1058967798 /nfs/dbraw/zinc/96/77/98/1058967798.db2.gz DPDKPMVRQSTQEO-UHFFFAOYSA-N 1 1 333.413 4.096 20 5 EIBDMO C[C@H]([NH2+]Cc1ccon1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000766422685 1060341078 /nfs/dbraw/zinc/34/10/78/1060341078.db2.gz VRVHLTPBZWXLKB-NSHDSACASA-N 1 1 329.381 4.162 20 5 EIBDMO CC[N@@H+](Cc1ccc(Cl)cc1Cl)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169045419 1060598671 /nfs/dbraw/zinc/59/86/71/1060598671.db2.gz JCJIIPKWIZCECD-SMDDNHRTSA-N 1 1 331.243 4.261 20 5 EIBDMO CCC[C@@]1(COC)CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC001169781096 1060965602 /nfs/dbraw/zinc/96/56/02/1060965602.db2.gz RSDAMPLURPHCCS-INIZCTEOSA-N 1 1 326.824 4.029 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCCSCC3)s2)cc1 ZINC000508636715 1032548437 /nfs/dbraw/zinc/54/84/37/1032548437.db2.gz GEVMXJSCRVFZLB-UHFFFAOYSA-N 1 1 334.466 4.262 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1c1cccn1C ZINC000533334737 1032662322 /nfs/dbraw/zinc/66/23/22/1032662322.db2.gz IOKNVEGBSJMYLF-GOSISDBHSA-N 1 1 343.427 4.058 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1c1cccn1C ZINC000533334737 1032662338 /nfs/dbraw/zinc/66/23/38/1032662338.db2.gz IOKNVEGBSJMYLF-GOSISDBHSA-N 1 1 343.427 4.058 20 5 EIBDMO CCC1CCC([N@@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000533447124 1032779354 /nfs/dbraw/zinc/77/93/54/1032779354.db2.gz GZRCHUGQRISSDP-UHFFFAOYSA-N 1 1 344.415 4.045 20 5 EIBDMO CSC[C@@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000430189340 1019066467 /nfs/dbraw/zinc/06/64/67/1019066467.db2.gz DCJRZIXIDIZEBC-CQSZACIVSA-N 1 1 346.452 4.430 20 5 EIBDMO CSC[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000430193540 1019107583 /nfs/dbraw/zinc/10/75/83/1019107583.db2.gz FNXRZFBYGLMOCM-AWEZNQCLSA-N 1 1 346.452 4.430 20 5 EIBDMO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1OC)c1cc(F)ccc1F ZINC000430203860 1019289007 /nfs/dbraw/zinc/28/90/07/1019289007.db2.gz JOUKHGVQDPVIPE-MRXNPFEDSA-N 1 1 336.338 4.123 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])CC[C@@H]1c1ccccc1 ZINC000610216209 1019397710 /nfs/dbraw/zinc/39/77/10/1019397710.db2.gz ZRXWBPYKOMLOTE-ZBFHGGJFSA-N 1 1 328.387 4.360 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC000430217344 1019425271 /nfs/dbraw/zinc/42/52/71/1019425271.db2.gz HLMBGRAZDSXYFR-KRWDZBQOSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC000430217344 1019425286 /nfs/dbraw/zinc/42/52/86/1019425286.db2.gz HLMBGRAZDSXYFR-KRWDZBQOSA-N 1 1 330.359 4.080 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](C(F)(F)F)C3(CCC3)C2)c(F)c1 ZINC000578241653 1019790216 /nfs/dbraw/zinc/79/02/16/1019790216.db2.gz OIJNGGNCOPLBNP-AWEZNQCLSA-N 1 1 346.324 4.288 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](C(F)(F)F)C3(CCC3)C2)c(F)c1 ZINC000578241653 1019790235 /nfs/dbraw/zinc/79/02/35/1019790235.db2.gz OIJNGGNCOPLBNP-AWEZNQCLSA-N 1 1 346.324 4.288 20 5 EIBDMO CCc1ccc([C@@H](COC)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000165246878 1019994162 /nfs/dbraw/zinc/99/41/62/1019994162.db2.gz QARKOLCXTIYEEJ-XJKSGUPXSA-N 1 1 332.400 4.097 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@]4(CC=CCC4)C3)nc2c1 ZINC000177076170 1020951194 /nfs/dbraw/zinc/95/11/94/1020951194.db2.gz GLAJJZRAOPIXGE-GOSISDBHSA-N 1 1 327.384 4.058 20 5 EIBDMO C[C@@H]1C[C@@H](c2ccccc2)C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083174498 1021016381 /nfs/dbraw/zinc/01/63/81/1021016381.db2.gz ZOKXURXRZPMCKJ-UKRRQHHQSA-N 1 1 337.379 4.114 20 5 EIBDMO C[C@H]1C[C@@H](c2ccccc2)C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083174499 1021017619 /nfs/dbraw/zinc/01/76/19/1021017619.db2.gz ZOKXURXRZPMCKJ-DZGCQCFKSA-N 1 1 337.379 4.114 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC001167332708 1021200583 /nfs/dbraw/zinc/20/05/83/1021200583.db2.gz QKGGYLQBXQJJQR-KRWDZBQOSA-N 1 1 340.423 4.058 20 5 EIBDMO C[C@@H](NCC[C@H](C)[N@@H+](C)Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000379624336 1021846033 /nfs/dbraw/zinc/84/60/33/1021846033.db2.gz JNFDVRMFDKRYKF-DLBZAZTESA-N 1 1 341.455 4.156 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1noc3ccccc13)CCCC2 ZINC000581439263 1021850853 /nfs/dbraw/zinc/85/08/53/1021850853.db2.gz PEYQIYIJBPDHAX-QGZVFWFLSA-N 1 1 337.379 4.293 20 5 EIBDMO CC[C@@H]1Cc2ccccc2C[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000613497418 1022187302 /nfs/dbraw/zinc/18/73/02/1022187302.db2.gz OYYMTCORPCZVQJ-OAHLLOKOSA-N 1 1 337.379 4.073 20 5 EIBDMO CC[C@@H]1Cc2ccccc2C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000613497418 1022187309 /nfs/dbraw/zinc/18/73/09/1022187309.db2.gz OYYMTCORPCZVQJ-OAHLLOKOSA-N 1 1 337.379 4.073 20 5 EIBDMO Cc1cc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc2cccnc12 ZINC000549408307 1022584407 /nfs/dbraw/zinc/58/44/07/1022584407.db2.gz NJBNHVLNDTYUCJ-UHFFFAOYSA-N 1 1 335.407 4.126 20 5 EIBDMO CC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H](C)C(C)C ZINC000120269265 1023154555 /nfs/dbraw/zinc/15/45/55/1023154555.db2.gz HCVRLCZUHVMHEK-AWEZNQCLSA-N 1 1 331.416 4.159 20 5 EIBDMO CCC[C@H]1[C@H](C)CCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000072776091 1023844962 /nfs/dbraw/zinc/84/49/62/1023844962.db2.gz JZISCOJRGMEVCL-CJNGLKHVSA-N 1 1 344.415 4.045 20 5 EIBDMO CCCCC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C(C)C ZINC000047628003 1024069811 /nfs/dbraw/zinc/06/98/11/1024069811.db2.gz YGFMSAPLAHBENN-UHFFFAOYSA-N 1 1 332.404 4.045 20 5 EIBDMO C[C@]1([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CCCc2ccccc21 ZINC000610582133 1024122817 /nfs/dbraw/zinc/12/28/17/1024122817.db2.gz XVEQPTWDVCKVEJ-IBGZPJMESA-N 1 1 337.379 4.077 20 5 EIBDMO CCOc1cc(C[NH2+][C@@](C)(CC)c2nc(C)cs2)ccc1[N+](=O)[O-] ZINC000276929848 1024800649 /nfs/dbraw/zinc/80/06/49/1024800649.db2.gz QSTBMMPJUVLEJG-KRWDZBQOSA-N 1 1 349.456 4.173 20 5 EIBDMO Cc1[nH+]c(N)ccc1CNc1ccc(-c2ccc([N+](=O)[O-])cc2)cc1 ZINC001167786353 1024831349 /nfs/dbraw/zinc/83/13/49/1024831349.db2.gz CWHGZLFVGSSFKN-UHFFFAOYSA-N 1 1 334.379 4.160 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+]Cc2ccc(C(F)(F)F)cn2)cc1[N+](=O)[O-] ZINC000278902241 1025388300 /nfs/dbraw/zinc/38/83/00/1025388300.db2.gz VIBCNSHMVLCGBV-NSHDSACASA-N 1 1 339.317 4.168 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCOc1ccccc1Cl ZINC000511058404 1026015712 /nfs/dbraw/zinc/01/57/12/1026015712.db2.gz RTCFXDDDOILVCI-ZDUSSCGKSA-N 1 1 334.803 4.320 20 5 EIBDMO CCCC[N@@H+](Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)[C@@H](C)CC ZINC000728898069 1026236594 /nfs/dbraw/zinc/23/65/94/1026236594.db2.gz VOOGWCNVTBPTGJ-HNNXBMFYSA-N 1 1 330.432 4.316 20 5 EIBDMO CCC(CC)[N@@H+](Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)C1CC1 ZINC000728899657 1026267143 /nfs/dbraw/zinc/26/71/43/1026267143.db2.gz ZKGKYDVDVNMIBE-UHFFFAOYSA-N 1 1 328.416 4.069 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)o1 ZINC000279432473 1026425940 /nfs/dbraw/zinc/42/59/40/1026425940.db2.gz GTUMLCXFSWJYNC-JTQLQIEISA-N 1 1 328.290 4.366 20 5 EIBDMO C[C@@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1nccn1-c1ccccc1 ZINC000582370695 1026499807 /nfs/dbraw/zinc/49/98/07/1026499807.db2.gz XKRIJRGNEWWYMX-RDTXWAMCSA-N 1 1 348.406 4.119 20 5 EIBDMO COCC[C@H]([NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)c1ccc(C)o1 ZINC000478259784 1026533513 /nfs/dbraw/zinc/53/35/13/1026533513.db2.gz UYJQDSWLRMSELP-KRWDZBQOSA-N 1 1 346.427 4.487 20 5 EIBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000178571618 1026693728 /nfs/dbraw/zinc/69/37/28/1026693728.db2.gz RQCHSISSBQGNFO-QZTJIDSGSA-N 1 1 346.814 4.119 20 5 EIBDMO COCc1ccccc1/C=C(\C)C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000507244796 1026720352 /nfs/dbraw/zinc/72/03/52/1026720352.db2.gz UFWVMPHPPDNXIF-FOWTUZBSSA-N 1 1 340.423 4.277 20 5 EIBDMO Cc1cccnc1[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000120857384 1026820126 /nfs/dbraw/zinc/82/01/26/1026820126.db2.gz ICNYLWUQMZDXEQ-INIZCTEOSA-N 1 1 333.819 4.439 20 5 EIBDMO COc1cc(F)c([C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000178656287 1027271174 /nfs/dbraw/zinc/27/11/74/1027271174.db2.gz KRJQBUPWWXYSIL-RYUDHWBXSA-N 1 1 348.374 4.163 20 5 EIBDMO C[C@@H]([NH2+]Cc1sccc1Br)c1ccc([N+](=O)[O-])cc1 ZINC000094259806 1027438432 /nfs/dbraw/zinc/43/84/32/1027438432.db2.gz LGRYDVBDTLXUHT-SECBINFHSA-N 1 1 341.230 4.270 20 5 EIBDMO C[C@H]1C[C@H](c2cccc(F)c2)[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000441323431 1027447376 /nfs/dbraw/zinc/44/73/76/1027447376.db2.gz MZZHQXBTCKIITJ-KBXCAEBGSA-N 1 1 344.386 4.196 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)Cc1cnc(C(C)C)nc1 ZINC000440485756 1027885445 /nfs/dbraw/zinc/88/54/45/1027885445.db2.gz NERFQEGIZJHCRD-CQSZACIVSA-N 1 1 328.416 4.010 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)Cc1cnc(C(C)C)nc1 ZINC000440485756 1027885447 /nfs/dbraw/zinc/88/54/47/1027885447.db2.gz NERFQEGIZJHCRD-CQSZACIVSA-N 1 1 328.416 4.010 20 5 EIBDMO C[C@@H]1SCC[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000522835835 1028986076 /nfs/dbraw/zinc/98/60/76/1028986076.db2.gz JGQPICGUEZRUTP-KBXCAEBGSA-N 1 1 328.437 4.273 20 5 EIBDMO C[C@@H]1SCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000522835835 1028986087 /nfs/dbraw/zinc/98/60/87/1028986087.db2.gz JGQPICGUEZRUTP-KBXCAEBGSA-N 1 1 328.437 4.273 20 5 EIBDMO C[C@@H]1SCC[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000522835837 1028987990 /nfs/dbraw/zinc/98/79/90/1028987990.db2.gz JGQPICGUEZRUTP-KSSFIOAISA-N 1 1 328.437 4.273 20 5 EIBDMO C[C@@H]1SCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000522835837 1028988001 /nfs/dbraw/zinc/98/80/01/1028988001.db2.gz JGQPICGUEZRUTP-KSSFIOAISA-N 1 1 328.437 4.273 20 5 EIBDMO COc1ccc2c(c1)CCC[N@@H+]([C@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000525786609 1030021193 /nfs/dbraw/zinc/02/11/93/1030021193.db2.gz JMQZNZZAVKCTRU-CQSZACIVSA-N 1 1 326.396 4.113 20 5 EIBDMO O=[N+]([O-])c1ncccc1C[N@@H+](CCc1ccc(F)cc1)C1CCCC1 ZINC001168163024 1030190631 /nfs/dbraw/zinc/19/06/31/1030190631.db2.gz AWBNMJFVMYHIHS-UHFFFAOYSA-N 1 1 343.402 4.116 20 5 EIBDMO CC(C)[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC(C)(C)C1 ZINC000452105409 1030843633 /nfs/dbraw/zinc/84/36/33/1030843633.db2.gz OBDHMAMVXVGNTO-UHFFFAOYSA-N 1 1 344.415 4.044 20 5 EIBDMO CC[C@H](c1ccccc1)[N@@H+](CC)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000532503271 1031225414 /nfs/dbraw/zinc/22/54/14/1031225414.db2.gz BJPLQOOBXCQRDY-QGZVFWFLSA-N 1 1 341.411 4.007 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2nc(C[NH2+][C@H](c3ccccc3)C3CC3)co2)cc1 ZINC000179690837 1031264379 /nfs/dbraw/zinc/26/43/79/1031264379.db2.gz YVPDHABKPFLYRY-LJQANCHMSA-N 1 1 349.390 4.491 20 5 EIBDMO CC(C)[N@@H+](Cc1cc2cccnc2o1)Cc1ccc([N+](=O)[O-])cc1 ZINC000449016753 1031349203 /nfs/dbraw/zinc/34/92/03/1031349203.db2.gz WTEJTWFVLZXUDO-UHFFFAOYSA-N 1 1 325.368 4.147 20 5 EIBDMO CC(C)[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000520183166 1031354194 /nfs/dbraw/zinc/35/41/94/1031354194.db2.gz JGDOMQHOQBCQNR-UHFFFAOYSA-N 1 1 332.375 4.023 20 5 EIBDMO C[C@@H]([NH2+][C@@H]1CCc2cc(F)c(F)c(F)c21)c1ccccc1[N+](=O)[O-] ZINC000449200939 1031544108 /nfs/dbraw/zinc/54/41/08/1031544108.db2.gz FXDFUJZFVQBXDB-NOZJJQNGSA-N 1 1 336.313 4.350 20 5 EIBDMO C[C@H]([NH2+]Cc1nc2c(s1)C[C@H](C)CC2)c1ccc([N+](=O)[O-])cc1 ZINC000449347833 1031646256 /nfs/dbraw/zinc/64/62/56/1031646256.db2.gz JGTNMHNMIKWWNK-NEPJUHHUSA-N 1 1 331.441 4.027 20 5 EIBDMO CCc1ccc([C@H]([NH2+]C2CC(C)(F)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453239099 1031761950 /nfs/dbraw/zinc/76/19/50/1031761950.db2.gz PSIJWGXWCJKJTO-LKGZKJKYSA-N 1 1 332.375 4.320 20 5 EIBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@@H]1C ZINC000449505630 1031814344 /nfs/dbraw/zinc/81/43/44/1031814344.db2.gz RIDOPOUFCBCPDI-SUMWQHHRSA-N 1 1 346.452 4.180 20 5 EIBDMO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000512643514 1033598529 /nfs/dbraw/zinc/59/85/29/1033598529.db2.gz DMZRZZMACMCFLU-QWHCGFSZSA-N 1 1 331.441 4.339 20 5 EIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+](Cc1cccc(O)c1)CC1CC1 ZINC000512682938 1033700216 /nfs/dbraw/zinc/70/02/16/1033700216.db2.gz KRJCIMFYYYTHEW-QPJJXVBHSA-N 1 1 338.407 4.226 20 5 EIBDMO Cc1ccc(C[N@H+](Cc2cccc(O)c2)CC2CC2)cc1[N+](=O)[O-] ZINC000512691035 1033722464 /nfs/dbraw/zinc/72/24/64/1033722464.db2.gz QZIUEBNPLWSLPX-UHFFFAOYSA-N 1 1 326.396 4.021 20 5 EIBDMO C[C@@H]([NH2+]Cc1cc(F)c(Cl)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000433088442 1033824303 /nfs/dbraw/zinc/82/43/03/1033824303.db2.gz MHHJUOAWLXMTOU-SECBINFHSA-N 1 1 326.730 4.377 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000182341407 1034803083 /nfs/dbraw/zinc/80/30/83/1034803083.db2.gz ZMTNEZQDURDJLA-CQSZACIVSA-N 1 1 337.379 4.409 20 5 EIBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1cccc(Br)c1 ZINC000404213636 1035009745 /nfs/dbraw/zinc/00/97/45/1035009745.db2.gz RKEPKXASHZMFTQ-UHFFFAOYSA-N 1 1 349.228 4.032 20 5 EIBDMO CCn1ccc(C[N@@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)c1 ZINC000616737759 1035330961 /nfs/dbraw/zinc/33/09/61/1035330961.db2.gz RMGKOOOSTIVLAU-UHFFFAOYSA-N 1 1 339.395 4.308 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183194332 1035336383 /nfs/dbraw/zinc/33/63/83/1035336383.db2.gz PXWRKSHUKXJITK-YESZJQIVSA-N 1 1 345.487 4.207 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183194332 1035336388 /nfs/dbraw/zinc/33/63/88/1035336388.db2.gz PXWRKSHUKXJITK-YESZJQIVSA-N 1 1 345.487 4.207 20 5 EIBDMO COc1ccc(F)cc1[C@@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595014839 1035508609 /nfs/dbraw/zinc/50/86/09/1035508609.db2.gz UQAHTGZBUCYYBM-NWDGAFQWSA-N 1 1 348.374 4.163 20 5 EIBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1cccc(OC2CC2)c1F ZINC000595070199 1035553099 /nfs/dbraw/zinc/55/30/99/1035553099.db2.gz UBSCXULSDGMPMF-MRXNPFEDSA-N 1 1 342.370 4.052 20 5 EIBDMO CC(C)[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1F ZINC000595686266 1035759168 /nfs/dbraw/zinc/75/91/68/1035759168.db2.gz UYQMHVNWTZKGOI-GOSISDBHSA-N 1 1 343.358 4.362 20 5 EIBDMO CC(C)[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1F ZINC000595693755 1035765756 /nfs/dbraw/zinc/76/57/56/1035765756.db2.gz UJTMGQLSNDDTPI-GOSISDBHSA-N 1 1 342.374 4.097 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@H]([C@H]2CCCCO2)C1 ZINC000595788865 1035793991 /nfs/dbraw/zinc/79/39/91/1035793991.db2.gz KGKPTHZTZVDFNS-WMLDXEAASA-N 1 1 338.835 4.029 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]3O[C@H](c4ccccc4)C[C@@H]32)cs1 ZINC000593126949 1035806565 /nfs/dbraw/zinc/80/65/65/1035806565.db2.gz ZCJIYKXNTBOLDC-ULQDDVLXSA-N 1 1 344.436 4.151 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]3O[C@H](c4ccccc4)C[C@@H]32)cs1 ZINC000593126949 1035806568 /nfs/dbraw/zinc/80/65/68/1035806568.db2.gz ZCJIYKXNTBOLDC-ULQDDVLXSA-N 1 1 344.436 4.151 20 5 EIBDMO COc1cc(C[N@H+]2CCC[C@H]2c2ccc(C)s2)ccc1[N+](=O)[O-] ZINC000485459154 1035893427 /nfs/dbraw/zinc/89/34/27/1035893427.db2.gz WMIZBNMHBJMRGL-HNNXBMFYSA-N 1 1 332.425 4.310 20 5 EIBDMO COC1CCC([N@@H+](C)Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602470200 1036459663 /nfs/dbraw/zinc/45/96/63/1036459663.db2.gz XKFXAVIWRJRHTJ-UHFFFAOYSA-N 1 1 346.349 4.003 20 5 EIBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH+]1CCC(C(F)F)CC1 ZINC000602471306 1036460215 /nfs/dbraw/zinc/46/02/15/1036460215.db2.gz BOMWVBVGKKIGAU-UHFFFAOYSA-N 1 1 338.276 4.091 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC=C(c3ccc(Cl)nc3)CC2)cc1F ZINC000366993501 1036494916 /nfs/dbraw/zinc/49/49/16/1036494916.db2.gz CWXJJNVRZISILL-UHFFFAOYSA-N 1 1 347.777 4.072 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC=C(c3ccc(Cl)nc3)CC2)cc1F ZINC000366993501 1036494924 /nfs/dbraw/zinc/49/49/24/1036494924.db2.gz CWXJJNVRZISILL-UHFFFAOYSA-N 1 1 347.777 4.072 20 5 EIBDMO C[C@@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)c1ccsc1 ZINC000602659149 1036556483 /nfs/dbraw/zinc/55/64/83/1036556483.db2.gz OLHOPVHOPZFJSC-SSDOTTSWSA-N 1 1 347.259 4.331 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](c2ccc3cccnc3n2)C1 ZINC000602888767 1036661073 /nfs/dbraw/zinc/66/10/73/1036661073.db2.gz RCUBUGXLDQZFBA-YOEHRIQHSA-N 1 1 348.406 4.089 20 5 EIBDMO Cc1n[nH]c(C)c1[C@H]1CCCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000589200108 1036706784 /nfs/dbraw/zinc/70/67/84/1036706784.db2.gz QKTNUSGEBSLHAU-QGZVFWFLSA-N 1 1 346.406 4.191 20 5 EIBDMO Cc1n[nH]c(C)c1[C@H]1CCCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000589200108 1036706806 /nfs/dbraw/zinc/70/68/06/1036706806.db2.gz QKTNUSGEBSLHAU-QGZVFWFLSA-N 1 1 346.406 4.191 20 5 EIBDMO CC(C)[N@@H+](Cc1cc2cnccc2o1)Cc1ccc([N+](=O)[O-])cc1 ZINC000593568191 1036708806 /nfs/dbraw/zinc/70/88/06/1036708806.db2.gz VAVJOYVTCOBYOJ-UHFFFAOYSA-N 1 1 325.368 4.147 20 5 EIBDMO COc1ccc2c(c1)C1(CC1)C[N@H+]([C@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000572651650 1036805972 /nfs/dbraw/zinc/80/59/72/1036805972.db2.gz KMBDTWMSBVFABX-CQSZACIVSA-N 1 1 338.407 4.212 20 5 EIBDMO COc1ccc2c(c1)C1(CC1)C[N@@H+]([C@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000572651650 1036805975 /nfs/dbraw/zinc/80/59/75/1036805975.db2.gz KMBDTWMSBVFABX-CQSZACIVSA-N 1 1 338.407 4.212 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1nsc3ccccc13)CCC2 ZINC000603430063 1036837101 /nfs/dbraw/zinc/83/71/01/1036837101.db2.gz RALPWHBSHPPGTC-INIZCTEOSA-N 1 1 339.420 4.372 20 5 EIBDMO CCC[C@H](C)[C@H]1CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000486780498 1036851368 /nfs/dbraw/zinc/85/13/68/1036851368.db2.gz VMPZCYFKJDFLQR-XJKSGUPXSA-N 1 1 344.415 4.045 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](c1ccccn1)C1CCC1 ZINC000599068008 1036868411 /nfs/dbraw/zinc/86/84/11/1036868411.db2.gz JPKYXUCWNSWFAR-YJYMSZOUSA-N 1 1 341.411 4.190 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@]4(CC4(F)F)C3)o2)cc1 ZINC000593695251 1036900281 /nfs/dbraw/zinc/90/02/81/1036900281.db2.gz ISQVKTZOXUCOKH-MRXNPFEDSA-N 1 1 334.322 4.086 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@]3(CC3(F)F)C2)o1 ZINC000593695616 1036900356 /nfs/dbraw/zinc/90/03/56/1036900356.db2.gz SMYRNIROXJAPPG-INIZCTEOSA-N 1 1 334.322 4.086 20 5 EIBDMO Cc1cnc(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)s1 ZINC000174573846 1036993825 /nfs/dbraw/zinc/99/38/25/1036993825.db2.gz SQKUBBNSZVHUIU-UHFFFAOYSA-N 1 1 345.449 4.378 20 5 EIBDMO C[N@@H+](CCCOc1cccc(Cl)c1)Cc1ccc([N+](=O)[O-])cc1 ZINC000603869739 1037065620 /nfs/dbraw/zinc/06/56/20/1037065620.db2.gz GIWBISQNXPCODO-UHFFFAOYSA-N 1 1 334.803 4.149 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC(F)(F)CC1 ZINC000599551253 1037072257 /nfs/dbraw/zinc/07/22/57/1037072257.db2.gz JTGDOGHBSIPMQO-UHFFFAOYSA-N 1 1 328.359 4.003 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC(F)(F)CC1 ZINC000599551253 1037072279 /nfs/dbraw/zinc/07/22/79/1037072279.db2.gz JTGDOGHBSIPMQO-UHFFFAOYSA-N 1 1 328.359 4.003 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc3ncccc3c2)c(Cl)c1 ZINC000183806093 1037270941 /nfs/dbraw/zinc/27/09/41/1037270941.db2.gz RYLHEMHYOIVZIF-UHFFFAOYSA-N 1 1 327.771 4.086 20 5 EIBDMO C[C@@H]1CSCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000488400438 1037566516 /nfs/dbraw/zinc/56/65/16/1037566516.db2.gz TUJFUWWRUVGEIX-ZDUSSCGKSA-N 1 1 332.425 4.040 20 5 EIBDMO CC[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCCC[C@H]1C ZINC000249397315 1037794966 /nfs/dbraw/zinc/79/49/66/1037794966.db2.gz RYZGCZHFJPZFCR-CZUORRHYSA-N 1 1 344.415 4.045 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)ccc1Br ZINC000157816561 1038054847 /nfs/dbraw/zinc/05/48/47/1038054847.db2.gz FZYLKPNPTSKSED-JSGCOSHPSA-N 1 1 339.233 4.122 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)ccc1Br ZINC000157816561 1038054873 /nfs/dbraw/zinc/05/48/73/1038054873.db2.gz FZYLKPNPTSKSED-JSGCOSHPSA-N 1 1 339.233 4.122 20 5 EIBDMO C[C@H](N[C@H]1CC[NH2+][C@H](C)C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423381310 1038195236 /nfs/dbraw/zinc/19/52/36/1038195236.db2.gz OJHASBMKGWFRQU-RDBSUJKOSA-N 1 1 345.468 4.114 20 5 EIBDMO Cc1cc(N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c(F)cc1[N+](=O)[O-] ZINC000461935719 1038838107 /nfs/dbraw/zinc/83/81/07/1038838107.db2.gz KQBJPGONPVGCEV-ZIAGYGMSSA-N 1 1 335.423 4.107 20 5 EIBDMO CCOc1ccc(C(C)=O)cc1C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000539328026 1038992975 /nfs/dbraw/zinc/99/29/75/1038992975.db2.gz NJFUAPNBKCCTGY-ZDUSSCGKSA-N 1 1 342.395 4.047 20 5 EIBDMO C[C@H]1CCC[C@H](C)[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000534121138 1039121620 /nfs/dbraw/zinc/12/16/20/1039121620.db2.gz JXACGSOSAOVDPI-KBPBESRZSA-N 1 1 329.400 4.260 20 5 EIBDMO C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000534121141 1039122007 /nfs/dbraw/zinc/12/20/07/1039122007.db2.gz JXACGSOSAOVDPI-ZIAGYGMSSA-N 1 1 329.400 4.260 20 5 EIBDMO Cc1ccc(C[NH2+]C2(c3ccc(F)cc3F)CCC2)cc1[N+](=O)[O-] ZINC000534239772 1039237180 /nfs/dbraw/zinc/23/71/80/1039237180.db2.gz GDKWHNNALTZLPD-UHFFFAOYSA-N 1 1 332.350 4.350 20 5 EIBDMO CCC[N@H+](Cc1csc([N+](=O)[O-])c1)[C@H]1CCCc2cccnc21 ZINC000481443994 1039441559 /nfs/dbraw/zinc/44/15/59/1039441559.db2.gz YZLMJKKGTRQCME-HNNXBMFYSA-N 1 1 331.441 4.341 20 5 EIBDMO CCC[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@H]1CCCc2cccnc21 ZINC000481443994 1039441602 /nfs/dbraw/zinc/44/16/02/1039441602.db2.gz YZLMJKKGTRQCME-HNNXBMFYSA-N 1 1 331.441 4.341 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000481707044 1039762519 /nfs/dbraw/zinc/76/25/19/1039762519.db2.gz MLEHOYKOORONNB-MGPUTAFESA-N 1 1 338.407 4.177 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000430105869 1039846910 /nfs/dbraw/zinc/84/69/10/1039846910.db2.gz OVJDESJKJRXZDP-XZGNNNQISA-N 1 1 337.423 4.476 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000430105869 1039846912 /nfs/dbraw/zinc/84/69/12/1039846912.db2.gz OVJDESJKJRXZDP-XZGNNNQISA-N 1 1 337.423 4.476 20 5 EIBDMO CC(C)c1ccc(C[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000434837509 1039881767 /nfs/dbraw/zinc/88/17/67/1039881767.db2.gz UJGGJIVDGFCQOG-UHFFFAOYSA-N 1 1 339.395 4.491 20 5 EIBDMO CC(C)c1ccc(C[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000434837509 1039881769 /nfs/dbraw/zinc/88/17/69/1039881769.db2.gz UJGGJIVDGFCQOG-UHFFFAOYSA-N 1 1 339.395 4.491 20 5 EIBDMO COc1ccc([C@H]2CCC[N@@H+]2Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000505608202 1040067224 /nfs/dbraw/zinc/06/72/24/1040067224.db2.gz KEBZYMHONDBAHJ-QGZVFWFLSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000505608202 1040067240 /nfs/dbraw/zinc/06/72/40/1040067240.db2.gz KEBZYMHONDBAHJ-QGZVFWFLSA-N 1 1 330.359 4.080 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1ccncc1F ZINC000510028726 1040119674 /nfs/dbraw/zinc/11/96/74/1040119674.db2.gz YYJWLRSNPFYGLQ-GFCCVEGCSA-N 1 1 341.342 4.240 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+](CC3CC3)C3CCCCC3)nc2c1 ZINC000482686929 1040428676 /nfs/dbraw/zinc/42/86/76/1040428676.db2.gz BGAYEUMJAANHIR-UHFFFAOYSA-N 1 1 328.416 4.016 20 5 EIBDMO Cc1ccc2c(c1)C[N@H+](CCc1ncc(-c3cccc([N+](=O)[O-])c3)o1)C2 ZINC000483332349 1040817615 /nfs/dbraw/zinc/81/76/15/1040817615.db2.gz BFJDSKWHZWJUIB-UHFFFAOYSA-N 1 1 349.390 4.117 20 5 EIBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000515539441 1040839900 /nfs/dbraw/zinc/83/99/00/1040839900.db2.gz PEMFRHBZABHAOW-IBGZPJMESA-N 1 1 326.396 4.249 20 5 EIBDMO C[C@@H]1CCSCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000483416152 1040847972 /nfs/dbraw/zinc/84/79/72/1040847972.db2.gz GRTZLNSEHNIGLZ-CYBMUJFWSA-N 1 1 332.425 4.182 20 5 EIBDMO C[C@H](NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000436286761 1041040330 /nfs/dbraw/zinc/04/03/30/1041040330.db2.gz BBWJVWFBDSZYNO-KXBFYZLASA-N 1 1 331.460 4.043 20 5 EIBDMO CC1(C)C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CC[C@H]1C(F)(F)F ZINC000484345372 1041218318 /nfs/dbraw/zinc/21/83/18/1041218318.db2.gz ZKXOINOJCGQPCS-CQSZACIVSA-N 1 1 330.350 4.048 20 5 EIBDMO CC1(C)C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CC[C@@H]1C(F)(F)F ZINC000484345371 1041218818 /nfs/dbraw/zinc/21/88/18/1041218818.db2.gz ZKXOINOJCGQPCS-AWEZNQCLSA-N 1 1 330.350 4.048 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425554045 1041251415 /nfs/dbraw/zinc/25/14/15/1041251415.db2.gz NVNCMZAVJALWFT-DNVCBOLYSA-N 1 1 344.455 4.245 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CC(c2ccccc2F)C1 ZINC000463039012 1041262743 /nfs/dbraw/zinc/26/27/43/1041262743.db2.gz RASQLBLURNWEOJ-ZROIWOOFSA-N 1 1 326.371 4.237 20 5 EIBDMO COc1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)ccc1C ZINC000436482788 1041265340 /nfs/dbraw/zinc/26/53/40/1041265340.db2.gz BRAQAGRPKMWFFY-UHFFFAOYSA-N 1 1 326.396 4.076 20 5 EIBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000007335635 1041447752 /nfs/dbraw/zinc/44/77/52/1041447752.db2.gz DWUCKVAOEJHTHG-QWHCGFSZSA-N 1 1 338.367 4.057 20 5 EIBDMO C[C@H](C1CCCCC1)[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000554839356 1041450911 /nfs/dbraw/zinc/45/09/11/1041450911.db2.gz MQLDJPZPIJJGNR-CYBMUJFWSA-N 1 1 344.415 4.045 20 5 EIBDMO CCC[C@H]1CCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000538752063 1041528288 /nfs/dbraw/zinc/52/82/88/1041528288.db2.gz GNLYGXDRXRIFOW-HNNXBMFYSA-N 1 1 342.443 4.007 20 5 EIBDMO COc1cc(C[N@@H+]2CCC[C@H]2c2ccccc2)c([N+](=O)[O-])cc1F ZINC000463469175 1041587899 /nfs/dbraw/zinc/58/78/99/1041587899.db2.gz JBUFBMMPERVADV-INIZCTEOSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1cc(C[N@H+]2CCC[C@H]2c2ccccc2)c([N+](=O)[O-])cc1F ZINC000463469175 1041587902 /nfs/dbraw/zinc/58/79/02/1041587902.db2.gz JBUFBMMPERVADV-INIZCTEOSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1cc(C[N@H+](C)[C@@H](C)c2ccccc2C)c([N+](=O)[O-])cc1F ZINC000463502714 1041595098 /nfs/dbraw/zinc/59/50/98/1041595098.db2.gz QKGLLXNFHWUVBF-ZDUSSCGKSA-N 1 1 332.375 4.244 20 5 EIBDMO COc1cc(C[N@@H+](C)[C@@H](C)c2ccccc2C)c([N+](=O)[O-])cc1F ZINC000463502714 1041595102 /nfs/dbraw/zinc/59/51/02/1041595102.db2.gz QKGLLXNFHWUVBF-ZDUSSCGKSA-N 1 1 332.375 4.244 20 5 EIBDMO COc1cccc([C@H]2C[C@@H](C)C[N@@H+]2Cc2csc([N+](=O)[O-])c2)c1 ZINC000541320199 1041892452 /nfs/dbraw/zinc/89/24/52/1041892452.db2.gz HEXHKLCFDIMTEP-MLGOLLRUSA-N 1 1 332.425 4.248 20 5 EIBDMO COc1cccc([C@H]2C[C@@H](C)C[N@H+]2Cc2csc([N+](=O)[O-])c2)c1 ZINC000541320199 1041892455 /nfs/dbraw/zinc/89/24/55/1041892455.db2.gz HEXHKLCFDIMTEP-MLGOLLRUSA-N 1 1 332.425 4.248 20 5 EIBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000464769627 1042149321 /nfs/dbraw/zinc/14/93/21/1042149321.db2.gz IJWFSTUJIRNXCK-KBPBESRZSA-N 1 1 328.865 4.354 20 5 EIBDMO CO[C@]1(C)CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000550000090 1042156301 /nfs/dbraw/zinc/15/63/01/1042156301.db2.gz NVPFCECKBJCCHA-OAHLLOKOSA-N 1 1 346.349 4.005 20 5 EIBDMO C[C@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@H](c2ccco2)C1 ZINC000464850632 1042197367 /nfs/dbraw/zinc/19/73/67/1042197367.db2.gz IMVDIPQBGWXDER-YOEHRIQHSA-N 1 1 330.384 4.040 20 5 EIBDMO C[C@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)C1 ZINC000443647019 1042215718 /nfs/dbraw/zinc/21/57/18/1042215718.db2.gz DCKFXUUDWJZZCP-LSDHHAIUSA-N 1 1 343.427 4.160 20 5 EIBDMO CC(C)c1ccc(C[NH+]2CCC(C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000506443532 1042427108 /nfs/dbraw/zinc/42/71/08/1042427108.db2.gz GBLGDEQTKDYHON-UHFFFAOYSA-N 1 1 330.350 4.493 20 5 EIBDMO COCCCC[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000052798182 1042449629 /nfs/dbraw/zinc/44/96/29/1042449629.db2.gz ZNNVAMQMDWWTMA-UHFFFAOYSA-N 1 1 328.412 4.024 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+](CCc1cccc(F)c1)C1CC1 ZINC000506455995 1042452037 /nfs/dbraw/zinc/45/20/37/1042452037.db2.gz PEJVYWOYNHRVNT-UHFFFAOYSA-N 1 1 332.350 4.080 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+](CCc1cccc(F)c1)C1CC1 ZINC000506455995 1042452039 /nfs/dbraw/zinc/45/20/39/1042452039.db2.gz PEJVYWOYNHRVNT-UHFFFAOYSA-N 1 1 332.350 4.080 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000506482775 1042497117 /nfs/dbraw/zinc/49/71/17/1042497117.db2.gz UOXDJYWZXZCNFT-KURKYZTESA-N 1 1 345.487 4.242 20 5 EIBDMO CC(C)([NH2+]Cc1cc(Cl)cc2c1OCC2)c1ccccc1[N+](=O)[O-] ZINC000491994232 1042529290 /nfs/dbraw/zinc/52/92/90/1042529290.db2.gz CWMKXLKQKCUGBM-UHFFFAOYSA-N 1 1 346.814 4.208 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H]1CCCc2ccccc21 ZINC000015291621 1042616421 /nfs/dbraw/zinc/61/64/21/1042616421.db2.gz KPERQMLBOFQQMM-GOSISDBHSA-N 1 1 326.396 4.113 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCS[C@H]3CCCC[C@@H]32)cc1Cl ZINC000761513608 1042874343 /nfs/dbraw/zinc/87/43/43/1042874343.db2.gz AXKAMLYGJPVZBV-GJZGRUSLSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)cc1Cl ZINC000761513608 1042874346 /nfs/dbraw/zinc/87/43/46/1042874346.db2.gz AXKAMLYGJPVZBV-GJZGRUSLSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@H]3/C=C\c3ccccc3)nc2c1 ZINC000611554677 1043047535 /nfs/dbraw/zinc/04/75/35/1043047535.db2.gz RVMCKORUPPJBLA-QWGSZXSUSA-N 1 1 349.390 4.414 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H]3/C=C\c3ccccc3)nc2c1 ZINC000611554677 1043047549 /nfs/dbraw/zinc/04/75/49/1043047549.db2.gz RVMCKORUPPJBLA-QWGSZXSUSA-N 1 1 349.390 4.414 20 5 EIBDMO Cc1c(C[NH2+][C@@H](c2ncc[nH]2)C2CCCCC2)cccc1[N+](=O)[O-] ZINC000556890698 1043232312 /nfs/dbraw/zinc/23/23/12/1043232312.db2.gz QJCMUKYEJPFVHX-QGZVFWFLSA-N 1 1 328.416 4.038 20 5 EIBDMO C[C@H]1CCC[N@@H+](CCCCNc2nc3ccc([N+](=O)[O-])cc3s2)C1 ZINC000731206210 1043718173 /nfs/dbraw/zinc/71/81/73/1043718173.db2.gz BHMOZBBXSUTFNB-ZDUSSCGKSA-N 1 1 348.472 4.129 20 5 EIBDMO C[C@H]([NH2+][C@@H](CN1CCCC1)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000173304432 1043889028 /nfs/dbraw/zinc/88/90/28/1043889028.db2.gz QJSUSTJRRAKPFE-JXFKEZNVSA-N 1 1 339.439 4.083 20 5 EIBDMO CC[NH+](CC)Cc1cccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173331148 1043895207 /nfs/dbraw/zinc/89/52/07/1043895207.db2.gz CEUVSUNMERSTMH-MRXNPFEDSA-N 1 1 341.455 4.287 20 5 EIBDMO Cc1nc2ccc(C[NH2+]Cc3ccc([N+](=O)[O-])cc3Cl)cc2s1 ZINC000494845012 1044435622 /nfs/dbraw/zinc/43/56/22/1044435622.db2.gz FEPPSSIKEJXNBR-UHFFFAOYSA-N 1 1 347.827 4.456 20 5 EIBDMO Cc1ccccc1C[C@H]1CCC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000734149678 1044496834 /nfs/dbraw/zinc/49/68/34/1044496834.db2.gz FMWWTZPYHXXMBG-GOSISDBHSA-N 1 1 328.387 4.249 20 5 EIBDMO CC(C)CCn1cccc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000466451599 1044511798 /nfs/dbraw/zinc/51/17/98/1044511798.db2.gz LCFPUINGLRBUAV-UHFFFAOYSA-N 1 1 335.835 4.386 20 5 EIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+](CCC(F)(F)F)CC1CC1 ZINC000091901474 1044716740 /nfs/dbraw/zinc/71/67/40/1044716740.db2.gz ZWKLKFRHIBEHNV-HWKANZROSA-N 1 1 328.334 4.272 20 5 EIBDMO CCOC[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000093419164 1044835486 /nfs/dbraw/zinc/83/54/86/1044835486.db2.gz YGYZLOCSEHNWHM-HNNXBMFYSA-N 1 1 344.411 4.103 20 5 EIBDMO CC[C@@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1cccc([N+](=O)[O-])c1 ZINC000154822691 1044840273 /nfs/dbraw/zinc/84/02/73/1044840273.db2.gz HQFZNGWIGXJQGT-GOSISDBHSA-N 1 1 337.379 4.491 20 5 EIBDMO CC[C@@H](c1ccc(F)cc1)[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000738298302 1045056948 /nfs/dbraw/zinc/05/69/48/1045056948.db2.gz HYTLFGRNBWKVES-KRWDZBQOSA-N 1 1 343.402 4.007 20 5 EIBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2c(Cl)cc([N+](=O)[O-])cc2Cl)C1 ZINC000302019463 1045155661 /nfs/dbraw/zinc/15/56/61/1045155661.db2.gz GZWDVAVRVRSXLQ-NSHDSACASA-N 1 1 346.258 4.070 20 5 EIBDMO Cc1cccc(NC[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)c1[N+](=O)[O-] ZINC000302490427 1045179500 /nfs/dbraw/zinc/17/95/00/1045179500.db2.gz JVOIPEWWYHTLLN-RDTXWAMCSA-N 1 1 345.468 4.460 20 5 EIBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc2nsnc21 ZINC000766020028 1045227663 /nfs/dbraw/zinc/22/76/63/1045227663.db2.gz ZYRZHCFWJVMJNW-UHFFFAOYSA-N 1 1 342.424 4.010 20 5 EIBDMO CC(C)c1ccc([C@H]2CCCC[N@@H+]2Cc2c([N+](=O)[O-])ncn2C)cc1 ZINC000611210803 1045260835 /nfs/dbraw/zinc/26/08/35/1045260835.db2.gz VJPYSKGUVRHTRQ-QGZVFWFLSA-N 1 1 342.443 4.179 20 5 EIBDMO CC(C)c1ccc([C@H]2CCCC[N@H+]2Cc2c([N+](=O)[O-])ncn2C)cc1 ZINC000611210803 1045260844 /nfs/dbraw/zinc/26/08/44/1045260844.db2.gz VJPYSKGUVRHTRQ-QGZVFWFLSA-N 1 1 342.443 4.179 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1COc2c1cccc2Cl ZINC000611336821 1045283638 /nfs/dbraw/zinc/28/36/38/1045283638.db2.gz NFCROYSIHGOFHC-MEDUHNTESA-N 1 1 332.787 4.341 20 5 EIBDMO Cc1c(C[NH2+][C@@H](c2ccccc2)c2cccnc2)cccc1[N+](=O)[O-] ZINC000790695329 1045561159 /nfs/dbraw/zinc/56/11/59/1045561159.db2.gz NLGLEQPFGRAAHY-FQEVSTJZSA-N 1 1 333.391 4.177 20 5 EIBDMO C[N@H+](Cc1cccc2[nH]ccc21)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000768214502 1045753951 /nfs/dbraw/zinc/75/39/51/1045753951.db2.gz BZJHHMQLAOQCRD-UHFFFAOYSA-N 1 1 329.787 4.362 20 5 EIBDMO C[N@@H+](Cc1cccc2[nH]ccc21)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000768214502 1045753963 /nfs/dbraw/zinc/75/39/63/1045753963.db2.gz BZJHHMQLAOQCRD-UHFFFAOYSA-N 1 1 329.787 4.362 20 5 EIBDMO Cc1cc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cnc1Cl ZINC000768337590 1045792169 /nfs/dbraw/zinc/79/21/69/1045792169.db2.gz VJEPKAXDYBJMFO-UHFFFAOYSA-N 1 1 331.803 4.116 20 5 EIBDMO Cc1cc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cnc1Cl ZINC000768337590 1045792184 /nfs/dbraw/zinc/79/21/84/1045792184.db2.gz VJEPKAXDYBJMFO-UHFFFAOYSA-N 1 1 331.803 4.116 20 5 EIBDMO Cc1noc(C[N@H+](CC(C)C)[C@H](C)c2ccccc2C)c1[N+](=O)[O-] ZINC001170245535 1045950868 /nfs/dbraw/zinc/95/08/68/1045950868.db2.gz WQWBRWZESUCBNK-OAHLLOKOSA-N 1 1 331.416 4.419 20 5 EIBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC001170347167 1046019349 /nfs/dbraw/zinc/01/93/49/1046019349.db2.gz QYRVBLAPXDIHTG-CZUORRHYSA-N 1 1 346.452 4.433 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@]2(C)[C@H](C1)C2(Cl)Cl ZINC000792907972 1046101808 /nfs/dbraw/zinc/10/18/08/1046101808.db2.gz QJMQQUGMBHVCOH-TUKIKUTGSA-N 1 1 343.254 4.480 20 5 EIBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)[C@H](c1ccccc1)N(C)C ZINC000769930536 1046115006 /nfs/dbraw/zinc/11/50/06/1046115006.db2.gz LDXZCTXEBQBGAP-SCLBCKFNSA-N 1 1 347.846 4.029 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CCc3ccc(F)c(F)c3)C2)cc1 ZINC001170424726 1046127555 /nfs/dbraw/zinc/12/75/55/1046127555.db2.gz PRAJIMGJERDFQQ-MRXNPFEDSA-N 1 1 346.377 4.295 20 5 EIBDMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000536669397 1046620293 /nfs/dbraw/zinc/62/02/93/1046620293.db2.gz BBCSBTCDRCCQQG-DOMZBBRYSA-N 1 1 331.441 4.339 20 5 EIBDMO COc1ccc(C[N@@H+](C)[C@H](c2ccccc2)C(C)C)cc1[N+](=O)[O-] ZINC000497396171 1046799801 /nfs/dbraw/zinc/79/98/01/1046799801.db2.gz JZIGFVSGHPELGD-IBGZPJMESA-N 1 1 328.412 4.433 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCOc3c(F)cccc32)cc1Cl ZINC000785991384 1046800394 /nfs/dbraw/zinc/80/03/94/1046800394.db2.gz LGFWGWSRGZBMLF-AWEZNQCLSA-N 1 1 336.750 4.001 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)c1nc2c(s1)CCC2 ZINC000459634165 1046825829 /nfs/dbraw/zinc/82/58/29/1046825829.db2.gz QINNALXVZFCDLO-NWDGAFQWSA-N 1 1 331.441 4.260 20 5 EIBDMO Cc1ccccc1[C@@H]1CCC[N@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000917484195 1046906759 /nfs/dbraw/zinc/90/67/59/1046906759.db2.gz WTJQYMLTHIJYKQ-SFHVURJKSA-N 1 1 336.395 4.048 20 5 EIBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000746672702 1046988173 /nfs/dbraw/zinc/98/81/73/1046988173.db2.gz HFDJHDXENSISPR-KBPBESRZSA-N 1 1 328.865 4.354 20 5 EIBDMO O=[N+]([O-])c1cccc(Br)c1C[NH+]1CCC2(CCC2)CC1 ZINC001170075792 1047036180 /nfs/dbraw/zinc/03/61/80/1047036180.db2.gz UTIVONWSTFLXHJ-UHFFFAOYSA-N 1 1 339.233 4.123 20 5 EIBDMO CC[C@H](c1ccccc1)[C@@H]1CCC[N@H+]1Cn1nc(C)c([N+](=O)[O-])c1C ZINC000746713913 1047068463 /nfs/dbraw/zinc/06/84/63/1047068463.db2.gz YEFZBLUHBBERQE-MSOLQXFVSA-N 1 1 342.443 4.024 20 5 EIBDMO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788502222 1047207539 /nfs/dbraw/zinc/20/75/39/1047207539.db2.gz ICFNGNNWWXCHFS-XOBRGWDASA-N 1 1 348.406 4.012 20 5 EIBDMO C[C@@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788507481 1047209248 /nfs/dbraw/zinc/20/92/48/1047209248.db2.gz QQPUXGMWYSLCDJ-YJYMSZOUSA-N 1 1 337.379 4.210 20 5 EIBDMO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC(F)(c2ccccc2)CC1 ZINC000789309270 1047399394 /nfs/dbraw/zinc/39/93/94/1047399394.db2.gz IQABTPYYNGZHFC-UHFFFAOYSA-N 1 1 332.350 4.195 20 5 EIBDMO Cc1ccc(OC(F)F)c([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])c1 ZINC000089511883 1047777279 /nfs/dbraw/zinc/77/72/79/1047777279.db2.gz XCISHRGGWMKADK-LBPRGKRZSA-N 1 1 336.338 4.355 20 5 EIBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000919722058 1048029562 /nfs/dbraw/zinc/02/95/62/1048029562.db2.gz SJQAPVPXPQYGKD-GUTXKFCHSA-N 1 1 337.851 4.090 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@@H](CC4CC4)C3)cs2)c1 ZINC000556958325 1048319813 /nfs/dbraw/zinc/31/98/13/1048319813.db2.gz CMJQNNFHBSACPW-AWEZNQCLSA-N 1 1 343.452 4.340 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1c(F)cc(F)cc1F ZINC000815152749 1048348309 /nfs/dbraw/zinc/34/83/09/1048348309.db2.gz UXTQHSVLSANNGB-WZUFQYTHSA-N 1 1 336.313 4.205 20 5 EIBDMO CO[C@H](C)C[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C(C)C ZINC000809949024 1048579885 /nfs/dbraw/zinc/57/98/85/1048579885.db2.gz WAHPYFMQSJYRSZ-SNVBAGLBSA-N 1 1 335.231 4.147 20 5 EIBDMO CC(C)[N@@H+](CCOc1cccc(F)c1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350850 1049052393 /nfs/dbraw/zinc/05/23/93/1049052393.db2.gz SYAOSFUCEPKLAS-UHFFFAOYSA-N 1 1 332.375 4.023 20 5 EIBDMO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000609625741 1049214810 /nfs/dbraw/zinc/21/48/10/1049214810.db2.gz XFBMQZWPLYMKNZ-QGZVFWFLSA-N 1 1 326.396 4.113 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+](CCc1ccc(F)cc1)C1CC1 ZINC000609744772 1049298452 /nfs/dbraw/zinc/29/84/52/1049298452.db2.gz WSGSKHRMSQLLQK-UHFFFAOYSA-N 1 1 332.350 4.080 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+](CCc1ccc(F)cc1)C1CC1 ZINC000609744772 1049298465 /nfs/dbraw/zinc/29/84/65/1049298465.db2.gz WSGSKHRMSQLLQK-UHFFFAOYSA-N 1 1 332.350 4.080 20 5 EIBDMO COc1cc(C)ccc1[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000773040690 1049546638 /nfs/dbraw/zinc/54/66/38/1049546638.db2.gz LLQQUTWWZLGEDI-GFCCVEGCSA-N 1 1 334.803 4.416 20 5 EIBDMO CC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812849683 1049609811 /nfs/dbraw/zinc/60/98/11/1049609811.db2.gz RFAHPSYOPDTLGW-SCLBCKFNSA-N 1 1 348.830 4.192 20 5 EIBDMO CC[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])[C@H](C)[C@H](O)c1ccccc1 ZINC000812849300 1049611238 /nfs/dbraw/zinc/61/12/38/1049611238.db2.gz NHJVYLGTGWDZDL-ACJLOTCBSA-N 1 1 348.830 4.192 20 5 EIBDMO C[C@@]1(c2cccc(F)c2)CC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001171771790 1049794730 /nfs/dbraw/zinc/79/47/30/1049794730.db2.gz IVJOGDOMLQGULP-GOSISDBHSA-N 1 1 332.350 4.037 20 5 EIBDMO CCN1CC[C@H]([N@@H+](C)Cc2c3ccccc3cc3ccccc32)CC1=O ZINC001172046678 1049842999 /nfs/dbraw/zinc/84/29/99/1049842999.db2.gz RFIXDIAPHRKYEB-IBGZPJMESA-N 1 1 346.474 4.436 20 5 EIBDMO C[C@@H]1CC[N@@H+](Cc2c3ccccc3cc3ccccc32)CC[S@]1=O ZINC000763490236 1050062049 /nfs/dbraw/zinc/06/20/49/1050062049.db2.gz KFRMGTMUXIEJEE-VOIUYBSRSA-N 1 1 337.488 4.336 20 5 EIBDMO CC1(C)C[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCC1(F)F ZINC001172904556 1050207337 /nfs/dbraw/zinc/20/73/37/1050207337.db2.gz OLXRQKRXMRFPTH-HNNXBMFYSA-N 1 1 338.398 4.209 20 5 EIBDMO C[N@@H+](Cc1ccccc1F)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172917633 1050233403 /nfs/dbraw/zinc/23/34/03/1050233403.db2.gz WGWLJYONWBYSSK-KRWDZBQOSA-N 1 1 328.387 4.113 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1C[C@@H]3C[C@H](C1)c1ccccc13)CC2 ZINC001172921661 1050234029 /nfs/dbraw/zinc/23/40/29/1050234029.db2.gz QKWMUJQAVXBPKO-CEXWTWQISA-N 1 1 348.446 4.429 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCC[C@@H](C(F)(F)F)C1)CC2 ZINC001172910876 1050246013 /nfs/dbraw/zinc/24/60/13/1050246013.db2.gz PRKKOEIEGDOPBD-HUUCEWRRSA-N 1 1 342.361 4.117 20 5 EIBDMO C[N@@H+](Cc1cccc(F)c1F)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172912774 1050247583 /nfs/dbraw/zinc/24/75/83/1050247583.db2.gz MCFYVBBDDQVHIE-MRXNPFEDSA-N 1 1 346.377 4.252 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+]Cc2csc(-c3ccoc3)n2)cc1[N+](=O)[O-] ZINC000181832477 1050348963 /nfs/dbraw/zinc/34/89/63/1050348963.db2.gz JQSURCSAHHUBPF-LBPRGKRZSA-N 1 1 343.408 4.471 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1nc2ccccc2s1 ZINC001173223011 1050355355 /nfs/dbraw/zinc/35/53/55/1050355355.db2.gz WEKAQKMQQJAPNY-CYBMUJFWSA-N 1 1 341.436 4.268 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCc1cccc(Cl)c1 ZINC001173233280 1050360484 /nfs/dbraw/zinc/36/04/84/1050360484.db2.gz KFRLZXKSWGXOQU-CQSZACIVSA-N 1 1 332.831 4.354 20 5 EIBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)NCC1CC1 ZINC001186622317 1050370598 /nfs/dbraw/zinc/37/05/98/1050370598.db2.gz DGJZFEQZKAFSSO-UHFFFAOYSA-N 1 1 348.450 4.294 20 5 EIBDMO Cc1cc([N+](=O)[O-])cnc1S[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001186757191 1050406445 /nfs/dbraw/zinc/40/64/45/1050406445.db2.gz NQUMOASKQQSFKO-KRWDZBQOSA-N 1 1 343.452 4.055 20 5 EIBDMO CCC[N@@H+](CC)C[C@@H](C)NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001178831110 1050567669 /nfs/dbraw/zinc/56/76/69/1050567669.db2.gz HRVIYVMWPGAAEJ-OAHLLOKOSA-N 1 1 345.443 4.065 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccc3c(c2)CCCO3)C2CC2)c1 ZINC001179909712 1050831435 /nfs/dbraw/zinc/83/14/35/1050831435.db2.gz SGUBUFLTGAERNW-UHFFFAOYSA-N 1 1 338.407 4.084 20 5 EIBDMO CC[C@@H]1C[C@@H](C)C[N@@H+]1Cc1cc(Br)c([N+](=O)[O-])s1 ZINC001180199378 1050926397 /nfs/dbraw/zinc/92/63/97/1050926397.db2.gz RJXWIEWJHRJXPL-RKDXNWHRSA-N 1 1 333.251 4.039 20 5 EIBDMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1cc(Br)c([N+](=O)[O-])s1 ZINC001180199378 1050926413 /nfs/dbraw/zinc/92/64/13/1050926413.db2.gz RJXWIEWJHRJXPL-RKDXNWHRSA-N 1 1 333.251 4.039 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2c(C)ccc([N+](=O)[O-])c2C)C2CC2)cc1 ZINC001180574492 1051025102 /nfs/dbraw/zinc/02/51/02/1051025102.db2.gz VPZULJSTAKWCRA-UHFFFAOYSA-N 1 1 340.423 4.385 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1CCc1ccccc1 ZINC001190392758 1051166726 /nfs/dbraw/zinc/16/67/26/1051166726.db2.gz SOSZUZWOUYHNSP-GOSISDBHSA-N 1 1 340.423 4.201 20 5 EIBDMO Cc1ccc([C@H](C)[N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC001190366646 1051170469 /nfs/dbraw/zinc/17/04/69/1051170469.db2.gz SJURLSDNWNJKRF-INIZCTEOSA-N 1 1 328.412 4.365 20 5 EIBDMO Cc1ccc(C[N@@H+](C)Cc2cccc(Br)c2)cc1[N+](=O)[O-] ZINC001190484865 1051187287 /nfs/dbraw/zinc/18/72/87/1051187287.db2.gz CVGFQGFIXYLNHR-UHFFFAOYSA-N 1 1 349.228 4.298 20 5 EIBDMO C[C@@H](c1ccccn1)[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000183676644 1051255338 /nfs/dbraw/zinc/25/53/38/1051255338.db2.gz UDVAZXDKRHYNDE-AWEZNQCLSA-N 1 1 337.379 4.443 20 5 EIBDMO COc1ccc(C[N@@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1C ZINC001190828015 1051286521 /nfs/dbraw/zinc/28/65/21/1051286521.db2.gz UEOBIDXSBVEZON-OAHLLOKOSA-N 1 1 328.412 4.413 20 5 EIBDMO C[C@]1(c2ccccc2)CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC001190944793 1051307711 /nfs/dbraw/zinc/30/77/11/1051307711.db2.gz REEDGUOPMRHNCB-FQEVSTJZSA-N 1 1 340.423 4.027 20 5 EIBDMO C[C@@]1(c2ccccc2)CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC001190943703 1051308004 /nfs/dbraw/zinc/30/80/04/1051308004.db2.gz BKSWILDHXIYJOV-HXUWFJFHSA-N 1 1 340.423 4.027 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCS[C@H]3CCCC[C@@H]32)c1 ZINC001191358540 1051428896 /nfs/dbraw/zinc/42/88/96/1051428896.db2.gz MQAKOFAVRDSBIN-GJZGRUSLSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)c1 ZINC001191358540 1051428902 /nfs/dbraw/zinc/42/89/02/1051428902.db2.gz MQAKOFAVRDSBIN-GJZGRUSLSA-N 1 1 326.849 4.108 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H](C)c1ccc(Cl)cc1 ZINC001175445151 1051596410 /nfs/dbraw/zinc/59/64/10/1051596410.db2.gz WGNWZJLBQBZOJA-LBPRGKRZSA-N 1 1 334.803 4.450 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H](C)c1ccc(Cl)cc1 ZINC001175445151 1051596420 /nfs/dbraw/zinc/59/64/20/1051596420.db2.gz WGNWZJLBQBZOJA-LBPRGKRZSA-N 1 1 334.803 4.450 20 5 EIBDMO CC(C)(C)OC[C@H]1CCC[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC001176009271 1051871470 /nfs/dbraw/zinc/87/14/70/1051871470.db2.gz LCIKWAGDXDWUDB-CQSZACIVSA-N 1 1 326.824 4.028 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](c2nc(C)cs2)C1 ZINC001183671487 1051882141 /nfs/dbraw/zinc/88/21/41/1051882141.db2.gz ILLWEKXQEUVUOU-RQPMMQJISA-N 1 1 343.452 4.253 20 5 EIBDMO Cc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C(C)C)s1 ZINC000774859776 1052224560 /nfs/dbraw/zinc/22/45/60/1052224560.db2.gz SYEJIAKIIXWYII-UHFFFAOYSA-N 1 1 349.412 4.284 20 5 EIBDMO Cc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C(C)C)s1 ZINC000774859776 1052224565 /nfs/dbraw/zinc/22/45/65/1052224565.db2.gz SYEJIAKIIXWYII-UHFFFAOYSA-N 1 1 349.412 4.284 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+](C3CC3)[C@H]3CCc4ccccc43)nc2c1 ZINC000083169188 1052845049 /nfs/dbraw/zinc/84/50/49/1052845049.db2.gz PEXZDHWIXKRGQL-SFHVURJKSA-N 1 1 349.390 4.388 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccn(C3CCCC3)n1)CCC2 ZINC000193031890 1053022434 /nfs/dbraw/zinc/02/24/34/1053022434.db2.gz XSFHYBTWHZRVJU-LJQANCHMSA-N 1 1 340.427 4.074 20 5 EIBDMO CCOc1cc(C[N@@H+](C)[C@H](C)Cc2cccc(F)c2)ccc1[N+](=O)[O-] ZINC001195013895 1053216298 /nfs/dbraw/zinc/21/62/98/1053216298.db2.gz MVMCNSCWAKKLJG-CQSZACIVSA-N 1 1 346.402 4.196 20 5 EIBDMO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)CCC2 ZINC000764937636 1053387637 /nfs/dbraw/zinc/38/76/37/1053387637.db2.gz DNPJQBCNCOLZQR-DYVFJYSZSA-N 1 1 328.416 4.100 20 5 EIBDMO C[C@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2)CCc2ccc(Cl)cc21 ZINC001195765878 1053475188 /nfs/dbraw/zinc/47/51/88/1053475188.db2.gz AEDBPEFLWFHYON-ZDUSSCGKSA-N 1 1 330.815 4.410 20 5 EIBDMO CC[C@H](c1ccccc1)[N@@H+](CC)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580271 1053563961 /nfs/dbraw/zinc/56/39/61/1053563961.db2.gz RWGKIXYCYSAHIX-MOPGFXCFSA-N 1 1 328.412 4.101 20 5 EIBDMO Cc1ccc([C@@H]2C[C@H](C)CC[N@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000776589550 1053575788 /nfs/dbraw/zinc/57/57/88/1053575788.db2.gz TVGRDIUJXZRUHC-BVGQSLNGSA-N 1 1 344.411 4.003 20 5 EIBDMO Cc1c(NC(=O)CC[N@H+]2CC(C)(C)CCC2(C)C)cccc1[N+](=O)[O-] ZINC001196276003 1053631715 /nfs/dbraw/zinc/63/17/15/1053631715.db2.gz RHOWXWLPEMLTKF-UHFFFAOYSA-N 1 1 347.459 4.132 20 5 EIBDMO CCC(CC)CCC[N@@H+](C)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC001196506260 1053686278 /nfs/dbraw/zinc/68/62/78/1053686278.db2.gz PQKOEYGMRHMMPP-CQSZACIVSA-N 1 1 335.448 4.070 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)c1cc2cnccc2o1 ZINC000866623078 1053810678 /nfs/dbraw/zinc/81/06/78/1053810678.db2.gz ROJOJTSWCVKBKP-RYUDHWBXSA-N 1 1 341.367 4.156 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@H]2[C@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC001198010204 1054045306 /nfs/dbraw/zinc/04/53/06/1054045306.db2.gz FSYOHCVUIMZTHZ-QAPCUYQASA-N 1 1 340.423 4.372 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1/C=C\c1ccccc1 ZINC001198271601 1054120081 /nfs/dbraw/zinc/12/00/81/1054120081.db2.gz XFYSQXINYZDZFB-HJCTWCACSA-N 1 1 338.407 4.281 20 5 EIBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc(Cl)nc1 ZINC000872025739 1054340715 /nfs/dbraw/zinc/34/07/15/1054340715.db2.gz SHOFXVDTOBYTJT-JTQLQIEISA-N 1 1 337.832 4.216 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H]1CCCc2cn(C(C)C)nc21 ZINC000873101706 1054486543 /nfs/dbraw/zinc/48/65/43/1054486543.db2.gz HUCPBZDPDWDLLQ-QGZVFWFLSA-N 1 1 342.443 4.156 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+]Cc2cc(C(F)(F)F)co2)cc1[N+](=O)[O-] ZINC000878371784 1055278278 /nfs/dbraw/zinc/27/82/78/1055278278.db2.gz QPSKSHRALSJDQI-JTQLQIEISA-N 1 1 328.290 4.366 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cn2cc(Cl)ccc2n1 ZINC000131569822 1055432262 /nfs/dbraw/zinc/43/22/62/1055432262.db2.gz YIQNZBSPOVZQGE-LBPRGKRZSA-N 1 1 344.802 4.055 20 5 EIBDMO COCC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccc(C)o1 ZINC000273102608 1055510424 /nfs/dbraw/zinc/51/04/24/1055510424.db2.gz VYOFSIHEFJAPBS-HNNXBMFYSA-N 1 1 338.791 4.017 20 5 EIBDMO CCOc1ccc([C@H](C)[NH2+][C@@H](C)c2nc(C)cs2)cc1[N+](=O)[O-] ZINC000153546131 1055517819 /nfs/dbraw/zinc/51/78/19/1055517819.db2.gz BKOBBROKABXRMO-RYUDHWBXSA-N 1 1 335.429 4.170 20 5 EIBDMO C[C@@H](NC[C@@H](c1ccccc1)[NH+]1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000327258677 1056390211 /nfs/dbraw/zinc/39/02/11/1056390211.db2.gz CSUONEMHLXJKOR-UZLBHIALSA-N 1 1 339.439 4.083 20 5 EIBDMO Cc1cc(C)cc([C@@H](O)C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000743258754 1058893548 /nfs/dbraw/zinc/89/35/48/1058893548.db2.gz WXPXVQDABZRQMK-SFHVURJKSA-N 1 1 348.830 4.030 20 5 EIBDMO Cc1cc(C)cc([C@@H](O)C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000743258754 1058893552 /nfs/dbraw/zinc/89/35/52/1058893552.db2.gz WXPXVQDABZRQMK-SFHVURJKSA-N 1 1 348.830 4.030 20 5 EIBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@H](c3cccc(Cl)c3Cl)C2)C1 ZINC001169035905 1060595297 /nfs/dbraw/zinc/59/52/97/1060595297.db2.gz MGMPLSUKMMDXAT-FRRDWIJNSA-N 1 1 343.254 4.228 20 5 EIBDMO CCOc1cc(C[N@H+]2CC[C@@H](c3cccc(C)c3)C2)ccc1[N+](=O)[O-] ZINC001169195950 1060680944 /nfs/dbraw/zinc/68/09/44/1060680944.db2.gz AODSCUZABFXIOD-GOSISDBHSA-N 1 1 340.423 4.291 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(C(=O)c2ccccc2)CC1 ZINC000036811518 526085314 /nfs/dbraw/zinc/08/53/14/526085314.db2.gz WSIWFQXAXXUUHA-OAHLLOKOSA-N 1 1 338.407 4.251 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ncoc1-c1ccccc1 ZINC000532247701 1032111669 /nfs/dbraw/zinc/11/16/69/1032111669.db2.gz DZLOSMPPFUSJOW-CQSZACIVSA-N 1 1 337.379 4.409 20 5 EIBDMO CCC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC(C)C ZINC000532929522 1032393856 /nfs/dbraw/zinc/39/38/56/1032393856.db2.gz CXRIAXNJKQWUDI-UHFFFAOYSA-N 1 1 331.416 4.160 20 5 EIBDMO COc1cccc(C=C2CC[NH+](Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000532378864 1032398592 /nfs/dbraw/zinc/39/85/92/1032398592.db2.gz JGLPOJPZKBEGHP-UHFFFAOYSA-N 1 1 338.407 4.283 20 5 EIBDMO C[C@@H]1C[C@@H](C)[C@@H](C)[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000475721413 1032501248 /nfs/dbraw/zinc/50/12/48/1032501248.db2.gz AZNFBCZTZKPUIA-RBSFLKMASA-N 1 1 343.427 4.159 20 5 EIBDMO C[C@@H]1C[C@@H](C)[C@H](C)[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000475742974 1032555942 /nfs/dbraw/zinc/55/59/42/1032555942.db2.gz VNJIWMRBVHCOEJ-MCIONIFRSA-N 1 1 329.400 4.116 20 5 EIBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1cccc(O)c1 ZINC000533255651 1032568722 /nfs/dbraw/zinc/56/87/22/1032568722.db2.gz AMMYBKKLIMEACX-UHFFFAOYSA-N 1 1 338.363 4.192 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](C(F)(F)F)C(C)(C)C1 ZINC000430236455 1019554036 /nfs/dbraw/zinc/55/40/36/1019554036.db2.gz AXLWWOHSZKFWMM-CQSZACIVSA-N 1 1 346.349 4.014 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](C(F)(F)F)C(C)(C)C1 ZINC000430236455 1019554050 /nfs/dbraw/zinc/55/40/50/1019554050.db2.gz AXLWWOHSZKFWMM-CQSZACIVSA-N 1 1 346.349 4.014 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CC[C@@H]3c3ccccc3)o2)c1 ZINC000471188474 1019735081 /nfs/dbraw/zinc/73/50/81/1019735081.db2.gz WEJAXFFJGHBKMN-GOSISDBHSA-N 1 1 349.390 4.239 20 5 EIBDMO CC(C)([NH2+]Cc1coc(-c2ccccc2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000119114379 1020471042 /nfs/dbraw/zinc/47/10/42/1020471042.db2.gz JPVLLWOTGCRDAY-UHFFFAOYSA-N 1 1 337.379 4.275 20 5 EIBDMO COc1ccc(C[N@@H+]2CC[C@@H](C)C[C@@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000610372204 1021553968 /nfs/dbraw/zinc/55/39/68/1021553968.db2.gz ZVQMNSSRFNXLPV-UKRRQHHQSA-N 1 1 330.384 4.170 20 5 EIBDMO COc1ccc(C[N@H+]2CC[C@@H](C)C[C@@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000610372204 1021553980 /nfs/dbraw/zinc/55/39/80/1021553980.db2.gz ZVQMNSSRFNXLPV-UKRRQHHQSA-N 1 1 330.384 4.170 20 5 EIBDMO Cc1nc(Nc2ccc3c(c2)[nH+]c2n3CCCCC2)ccc1[N+](=O)[O-] ZINC000471603805 1022315852 /nfs/dbraw/zinc/31/58/52/1022315852.db2.gz IJYMMRAUMLHXKK-UHFFFAOYSA-N 1 1 337.383 4.118 20 5 EIBDMO Cc1ccc(N[C@@H](Cc2[nH+]ccn2C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000610468732 1022724131 /nfs/dbraw/zinc/72/41/31/1022724131.db2.gz UOGIFLIMNJZDQM-KRWDZBQOSA-N 1 1 336.395 4.033 20 5 EIBDMO CCC(C)(C)[C@@H]1CCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000156732270 1022737899 /nfs/dbraw/zinc/73/78/99/1022737899.db2.gz SJTCUGYFGLHQGI-HNNXBMFYSA-N 1 1 344.415 4.045 20 5 EIBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000581154653 1022861016 /nfs/dbraw/zinc/86/10/16/1022861016.db2.gz MZYUFXOBJRBIDK-TXEJJXNPSA-N 1 1 334.313 4.287 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@H]1CCOc2c(F)cccc21 ZINC000276234382 1023254099 /nfs/dbraw/zinc/25/40/99/1023254099.db2.gz SSNJWGPAQGBARI-AWEZNQCLSA-N 1 1 336.750 4.001 20 5 EIBDMO C[N@H+](Cc1csc([N+](=O)[O-])c1)C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000051132230 1023470899 /nfs/dbraw/zinc/47/08/99/1023470899.db2.gz JVDCBKYWVGOWGK-SJLPKXTDSA-N 1 1 346.452 4.256 20 5 EIBDMO CC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1OC(F)F ZINC000101591769 1023760238 /nfs/dbraw/zinc/76/02/38/1023760238.db2.gz HLUWKJRUBRKEFO-AWEZNQCLSA-N 1 1 336.338 4.437 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@@H]4CCC[C@@H]43)cs2)c1 ZINC000511844093 1023931847 /nfs/dbraw/zinc/93/18/47/1023931847.db2.gz PLBDGVYXIGDJRZ-GUYCJALGSA-N 1 1 343.452 4.483 20 5 EIBDMO COc1ccc(CCC[N@@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000108722225 1024074024 /nfs/dbraw/zinc/07/40/24/1024074024.db2.gz KELRKEYZKGPRBV-HNNXBMFYSA-N 1 1 328.412 4.229 20 5 EIBDMO Cc1ccc([C@H](C)[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000610581153 1024116480 /nfs/dbraw/zinc/11/64/80/1024116480.db2.gz GKPBFMXBILBCCQ-ZDUSSCGKSA-N 1 1 325.368 4.237 20 5 EIBDMO C[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)[C@@H]2CCCC[C@@H]12 ZINC000610581894 1024132169 /nfs/dbraw/zinc/13/21/69/1024132169.db2.gz XNMCFCNGYKLFRP-IVMMDQJWSA-N 1 1 329.400 4.137 20 5 EIBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C(C1CC1)C1CC1 ZINC000549797540 1033204115 /nfs/dbraw/zinc/20/41/15/1033204115.db2.gz XSWCQJNKVLUQBU-UHFFFAOYSA-N 1 1 328.334 4.234 20 5 EIBDMO COc1ccccc1CC1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000549572555 1024539820 /nfs/dbraw/zinc/53/98/20/1024539820.db2.gz YYUBTCLNCHCJCT-UHFFFAOYSA-N 1 1 346.452 4.120 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2nc3ccccc3nc2C)cc1[N+](=O)[O-] ZINC000181826043 1024834150 /nfs/dbraw/zinc/83/41/50/1024834150.db2.gz MURORMFZQPNDPE-CYBMUJFWSA-N 1 1 336.395 4.006 20 5 EIBDMO C[C@H]1CCCC[N@H+]1CCC1CCN(c2ccsc2[N+](=O)[O-])CC1 ZINC000610786814 1024850800 /nfs/dbraw/zinc/85/08/00/1024850800.db2.gz DCEYQJJCQNQWPT-AWEZNQCLSA-N 1 1 337.489 4.137 20 5 EIBDMO COc1cc(C[NH2+][C@H](C)c2cc3ccccc3o2)c([N+](=O)[O-])cc1F ZINC000184406396 1024868351 /nfs/dbraw/zinc/86/83/51/1024868351.db2.gz FPMGOPIFFWBZKJ-LLVKDONJSA-N 1 1 344.342 4.340 20 5 EIBDMO CCc1ccc([C@H](COC)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)o1 ZINC000165261424 1025181971 /nfs/dbraw/zinc/18/19/71/1025181971.db2.gz XXJQSQLZMRXCHM-BBRMVZONSA-N 1 1 332.400 4.097 20 5 EIBDMO Cn1cccc1C[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000538719807 1025526033 /nfs/dbraw/zinc/52/60/33/1025526033.db2.gz JZCVFABTZLLRMV-UHFFFAOYSA-N 1 1 341.436 4.294 20 5 EIBDMO O=[N+]([O-])c1ccc(OCC[N@@H+](Cc2ccco2)C2CCCC2)cc1 ZINC000065535215 1025722921 /nfs/dbraw/zinc/72/29/21/1025722921.db2.gz QVACKXSTVSQMSN-UHFFFAOYSA-N 1 1 330.384 4.011 20 5 EIBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)CC1=Cc2ccccc2OC1 ZINC000507188986 1026677174 /nfs/dbraw/zinc/67/71/74/1026677174.db2.gz SOWAKCFGJIPOFT-UHFFFAOYSA-N 1 1 338.407 4.281 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](CC2=Cc3ccccc3OC2)C2CC2)cc1 ZINC000507170146 1026681814 /nfs/dbraw/zinc/68/18/14/1026681814.db2.gz ZKUZUOVCBUATEJ-UHFFFAOYSA-N 1 1 336.391 4.035 20 5 EIBDMO CCOc1cccc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000507167228 1026682154 /nfs/dbraw/zinc/68/21/54/1026682154.db2.gz KDHZBSLHFDZCGT-UHFFFAOYSA-N 1 1 326.396 4.158 20 5 EIBDMO CCOc1cccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000507167228 1026682161 /nfs/dbraw/zinc/68/21/61/1026682161.db2.gz KDHZBSLHFDZCGT-UHFFFAOYSA-N 1 1 326.396 4.158 20 5 EIBDMO C[C@@H](CC[N@@H+](C)CCc1ccccc1[N+](=O)[O-])OCc1ccccc1 ZINC000511138846 1026712747 /nfs/dbraw/zinc/71/27/47/1026712747.db2.gz GVSSVPXVQADJJN-KRWDZBQOSA-N 1 1 342.439 4.065 20 5 EIBDMO CC[C@H](C)[N@@H+](Cc1ccccc1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000507693939 1026876057 /nfs/dbraw/zinc/87/60/57/1026876057.db2.gz MSXFTOQCPGJXTG-HNNXBMFYSA-N 1 1 328.412 4.404 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](COCc2ccccc2)C1 ZINC000075866275 1027059426 /nfs/dbraw/zinc/05/94/26/1027059426.db2.gz FJDKFFWPMDVSIG-WMZOPIPTSA-N 1 1 340.423 4.195 20 5 EIBDMO CC(C)[N@H+](C)Cc1ccccc1CN[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000178644315 1027071510 /nfs/dbraw/zinc/07/15/10/1027071510.db2.gz LXFLUWZWFGKJIM-INIZCTEOSA-N 1 1 341.455 4.286 20 5 EIBDMO CC(C)[N@@H+](C)Cc1ccccc1CN[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000178644315 1027071513 /nfs/dbraw/zinc/07/15/13/1027071513.db2.gz LXFLUWZWFGKJIM-INIZCTEOSA-N 1 1 341.455 4.286 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cnc2ccsc2c1 ZINC000178730120 1027772249 /nfs/dbraw/zinc/77/22/49/1027772249.db2.gz QINLBQVSZUPZKO-NSHDSACASA-N 1 1 343.408 4.064 20 5 EIBDMO CC[C@H]1CCCC[C@H]1[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000444660190 1027933503 /nfs/dbraw/zinc/93/35/03/1027933503.db2.gz IXAQDPWKZIFWKZ-XJKSGUPXSA-N 1 1 344.415 4.045 20 5 EIBDMO C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(Cl)s1 ZINC000444683130 1027966558 /nfs/dbraw/zinc/96/65/58/1027966558.db2.gz DCPNSSZXZMNGHV-QMMMGPOBSA-N 1 1 336.804 4.037 20 5 EIBDMO CC[C@]1(C)CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000536350435 1028091841 /nfs/dbraw/zinc/09/18/41/1028091841.db2.gz XFAQJPVXKKTZSZ-GOSISDBHSA-N 1 1 329.400 4.262 20 5 EIBDMO CC[C@H](N[C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000248397847 1028124549 /nfs/dbraw/zinc/12/45/49/1028124549.db2.gz IGYKZUOQMAWHLY-SYNHAJSKSA-N 1 1 345.487 4.289 20 5 EIBDMO CC[C@H](N[C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000248397847 1028124558 /nfs/dbraw/zinc/12/45/58/1028124558.db2.gz IGYKZUOQMAWHLY-SYNHAJSKSA-N 1 1 345.487 4.289 20 5 EIBDMO Cc1ccc([C@H](C)N[C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000248393718 1028145620 /nfs/dbraw/zinc/14/56/20/1028145620.db2.gz FAWKMXGWSSTDMM-JZXOWHBKSA-N 1 1 345.487 4.207 20 5 EIBDMO Cc1ccc([C@H](C)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000248393718 1028145631 /nfs/dbraw/zinc/14/56/31/1028145631.db2.gz FAWKMXGWSSTDMM-JZXOWHBKSA-N 1 1 345.487 4.207 20 5 EIBDMO CSc1ccccc1[C@H](C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000440612012 1028197968 /nfs/dbraw/zinc/19/79/68/1028197968.db2.gz KKMQZAWXBHLDBN-NSHDSACASA-N 1 1 343.408 4.309 20 5 EIBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000524266224 1028834621 /nfs/dbraw/zinc/83/46/21/1028834621.db2.gz ZUXNPJQPLOKEOG-CQSZACIVSA-N 1 1 342.443 4.065 20 5 EIBDMO O=[N+]([O-])c1ccc(CC[N@@H+](Cc2ccc(F)cc2F)C2CC2)cc1 ZINC000524425761 1028958228 /nfs/dbraw/zinc/95/82/28/1028958228.db2.gz QNNDWSFLKRYHPJ-UHFFFAOYSA-N 1 1 332.350 4.080 20 5 EIBDMO C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCC(C)(C)CC1 ZINC000446713339 1029533631 /nfs/dbraw/zinc/53/36/31/1029533631.db2.gz WQXLFCIJNNCCBC-UHFFFAOYSA-N 1 1 344.415 4.045 20 5 EIBDMO Cc1nc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)sc1C ZINC000451549699 1030568074 /nfs/dbraw/zinc/56/80/74/1030568074.db2.gz QHPOMHLUSXVACP-HNNXBMFYSA-N 1 1 331.441 4.048 20 5 EIBDMO COC[C@H]([NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000530730147 1030664817 /nfs/dbraw/zinc/66/48/17/1030664817.db2.gz RAPSXBUZGIYPGY-SFHVURJKSA-N 1 1 346.402 4.335 20 5 EIBDMO CC(C)c1ccc(C[N@H+]2CC[C@H](Cc3ccncc3)C2)cc1[N+](=O)[O-] ZINC000611983750 1030679744 /nfs/dbraw/zinc/67/97/44/1030679744.db2.gz GFKOEBJITGRZDY-GOSISDBHSA-N 1 1 339.439 4.178 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H]2CCC2CCCC2)cc1 ZINC001168175582 1030681460 /nfs/dbraw/zinc/68/14/60/1030681460.db2.gz OKNQIRVEPUWKCA-PKOBYXMFSA-N 1 1 332.444 4.063 20 5 EIBDMO Cc1ccc(CNc2ccc([NH+]3CCCC3)cc2C)cc1[N+](=O)[O-] ZINC000237672146 1030847484 /nfs/dbraw/zinc/84/74/84/1030847484.db2.gz FEESCYMKGAGHRD-UHFFFAOYSA-N 1 1 325.412 4.424 20 5 EIBDMO CC[N@@H+](CCNCc1ccc(-c2ccccc2[N+](=O)[O-])s1)C(C)C ZINC000520220019 1031470299 /nfs/dbraw/zinc/47/02/99/1031470299.db2.gz UEDOPIVDJTTYKU-UHFFFAOYSA-N 1 1 347.484 4.143 20 5 EIBDMO CCN(CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C(C)C ZINC000520220019 1031470304 /nfs/dbraw/zinc/47/03/04/1031470304.db2.gz UEDOPIVDJTTYKU-UHFFFAOYSA-N 1 1 347.484 4.143 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cc4cccnc4o3)C2)cc1 ZINC000449503217 1031811609 /nfs/dbraw/zinc/81/16/09/1031811609.db2.gz SZQPCFPVYODUNZ-MRXNPFEDSA-N 1 1 337.379 4.116 20 5 EIBDMO CCCc1ncc(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)o1 ZINC000453352160 1031879827 /nfs/dbraw/zinc/87/98/27/1031879827.db2.gz CHRUQVCTJICCGP-INIZCTEOSA-N 1 1 329.400 4.048 20 5 EIBDMO C[C@@H]1CC[C@@H]([N@@H+](C)Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000433040094 1033708370 /nfs/dbraw/zinc/70/83/70/1033708370.db2.gz QVRSSHPZEUMFAJ-IUODEOHRSA-N 1 1 331.441 4.339 20 5 EIBDMO C[C@@H]1CC[C@H]([N@@H+](C)Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000433040093 1033708575 /nfs/dbraw/zinc/70/85/75/1033708575.db2.gz QVRSSHPZEUMFAJ-DOMZBBRYSA-N 1 1 331.441 4.339 20 5 EIBDMO CC(C)([NH2+]Cc1ccccc1OC(F)F)c1ccccc1[N+](=O)[O-] ZINC000292113333 1033885797 /nfs/dbraw/zinc/88/57/97/1033885797.db2.gz JGPLHQKTYUCOJX-UHFFFAOYSA-N 1 1 336.338 4.221 20 5 EIBDMO COCc1ccc([C@@H]2CCC[N@H+]2C/C=C/c2ccccc2[N+](=O)[O-])o1 ZINC000137077292 1034556682 /nfs/dbraw/zinc/55/66/82/1034556682.db2.gz IGMCNRLXJWSASR-UKTKYZJWSA-N 1 1 342.395 4.185 20 5 EIBDMO C[C@@H]1C[C@H](c2ccccc2)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000513235863 1034851612 /nfs/dbraw/zinc/85/16/12/1034851612.db2.gz GFUTXUNPUANJQK-FZKQIMNGSA-N 1 1 336.395 4.054 20 5 EIBDMO C[C@@H]1C[C@H](c2ccccc2)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000513235863 1034851613 /nfs/dbraw/zinc/85/16/13/1034851613.db2.gz GFUTXUNPUANJQK-FZKQIMNGSA-N 1 1 336.395 4.054 20 5 EIBDMO CCC[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC)c1ccccn1 ZINC000595015050 1035509059 /nfs/dbraw/zinc/50/90/59/1035509059.db2.gz XQRVCWOUQWZBNO-DYVFJYSZSA-N 1 1 329.400 4.190 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccc(Cl)s1 ZINC000595007568 1035528295 /nfs/dbraw/zinc/52/82/95/1035528295.db2.gz MKTKIIMZRDPQFK-SECBINFHSA-N 1 1 326.805 4.169 20 5 EIBDMO COCCCC[N@@H+](Cc1ccccc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595294546 1035618810 /nfs/dbraw/zinc/61/88/10/1035618810.db2.gz NWFWVIFHSSLUJI-UHFFFAOYSA-N 1 1 346.402 4.163 20 5 EIBDMO C[N@@H+](CCCOc1ccc(Cl)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000501834400 1035651143 /nfs/dbraw/zinc/65/11/43/1035651143.db2.gz WXQBWSWZOAXLDB-UHFFFAOYSA-N 1 1 334.803 4.149 20 5 EIBDMO CC(C)[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCCCC1 ZINC000491134638 1035808357 /nfs/dbraw/zinc/80/83/57/1035808357.db2.gz VYSQCFVNVFNGOP-UHFFFAOYSA-N 1 1 344.415 4.188 20 5 EIBDMO CC(C)(C)C[C@H]1CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000060877162 1036626349 /nfs/dbraw/zinc/62/63/49/1036626349.db2.gz SZGDYIVEQYQRQR-OAHLLOKOSA-N 1 1 344.415 4.045 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@]3(CC3(F)F)C2)o1 ZINC000593695617 1036902353 /nfs/dbraw/zinc/90/23/53/1036902353.db2.gz SMYRNIROXJAPPG-MRXNPFEDSA-N 1 1 334.322 4.086 20 5 EIBDMO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000590172030 1037012228 /nfs/dbraw/zinc/01/22/28/1037012228.db2.gz ZDILRADZCZYFHI-MRVPVSSYSA-N 1 1 343.305 4.069 20 5 EIBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@H](c3cc4ccccc4[nH]3)C2)cc1 ZINC000603890326 1037077218 /nfs/dbraw/zinc/07/72/18/1037077218.db2.gz ZVBXLIAZBAENAF-SFHVURJKSA-N 1 1 349.434 4.498 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H](c2cc3ccccc3[nH]2)C1 ZINC000603890289 1037078204 /nfs/dbraw/zinc/07/82/04/1037078204.db2.gz XXKKLFLWLNGSHV-MRXNPFEDSA-N 1 1 335.407 4.456 20 5 EIBDMO C[N@H+](CCCOc1ccc(Cl)cc1)Cc1csc([N+](=O)[O-])c1 ZINC000603936032 1037099411 /nfs/dbraw/zinc/09/94/11/1037099411.db2.gz CMBZUNDMWCNGDG-UHFFFAOYSA-N 1 1 340.832 4.211 20 5 EIBDMO C[N@@H+](CCCOc1ccc(Cl)cc1)Cc1csc([N+](=O)[O-])c1 ZINC000603936032 1037099426 /nfs/dbraw/zinc/09/94/26/1037099426.db2.gz CMBZUNDMWCNGDG-UHFFFAOYSA-N 1 1 340.832 4.211 20 5 EIBDMO C[C@H]1c2ccsc2CC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000604012531 1037147661 /nfs/dbraw/zinc/14/76/61/1037147661.db2.gz MOFNFTBUFWORTD-ZDUSSCGKSA-N 1 1 332.425 4.045 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@H]2c2cccc(C)c2)cc1[N+](=O)[O-] ZINC000604013343 1037150675 /nfs/dbraw/zinc/15/06/75/1037150675.db2.gz BSENXXNXKMYHGK-KRWDZBQOSA-N 1 1 326.396 4.249 20 5 EIBDMO Cc1cccc([C@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])c1 ZINC000604016820 1037151426 /nfs/dbraw/zinc/15/14/26/1037151426.db2.gz FAFVPKVOSKAGRJ-QGZVFWFLSA-N 1 1 326.396 4.119 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CC(CC(F)(F)F)C3)o2)cc1 ZINC000590969191 1037220600 /nfs/dbraw/zinc/22/06/00/1037220600.db2.gz DGDRNSJSEHLHTR-UHFFFAOYSA-N 1 1 340.301 4.239 20 5 EIBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000604520686 1037404451 /nfs/dbraw/zinc/40/44/51/1037404451.db2.gz CBVIPPNTAUSFOJ-ICSRJNTNSA-N 1 1 340.423 4.195 20 5 EIBDMO C[C@H]1CSCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000488372723 1037550200 /nfs/dbraw/zinc/55/02/00/1037550200.db2.gz UVLNXMNNYVUYEZ-CYBMUJFWSA-N 1 1 332.425 4.040 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@]1(c2ccc(Cl)cc2)C[C@@H]1C ZINC000503403016 1037737846 /nfs/dbraw/zinc/73/78/46/1037737846.db2.gz CQTTXIPVPUMKNZ-SGTLLEGYSA-N 1 1 346.814 4.282 20 5 EIBDMO C[C@@H]1C[C@]1([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000503402616 1037739131 /nfs/dbraw/zinc/73/91/31/1037739131.db2.gz BKYFIFKCLIIPEL-PIGZYNQJSA-N 1 1 334.778 4.412 20 5 EIBDMO CC/C=C/CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592132925 1037740232 /nfs/dbraw/zinc/74/02/32/1037740232.db2.gz PNZHYPVTJXMYRK-CTWCUAEASA-N 1 1 332.444 4.057 20 5 EIBDMO CCCO[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000172179800 1037888571 /nfs/dbraw/zinc/88/85/71/1037888571.db2.gz ALGFMYDNYWJQRE-HNNXBMFYSA-N 1 1 326.824 4.029 20 5 EIBDMO COc1cc(NCc2ccccc2C[N@@H+](C)C(C)C)ccc1[N+](=O)[O-] ZINC000462089998 1038897427 /nfs/dbraw/zinc/89/74/27/1038897427.db2.gz BSNJHZBCWZNOSS-UHFFFAOYSA-N 1 1 343.427 4.056 20 5 EIBDMO C[C@H]([NH2+][C@H](CN(C)C)c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000555226027 1038993729 /nfs/dbraw/zinc/99/37/29/1038993729.db2.gz OPBUFTQMRNSYKT-SCLBCKFNSA-N 1 1 347.846 4.202 20 5 EIBDMO C[C@H](O)C[C@H]1CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000537623384 1039003637 /nfs/dbraw/zinc/00/36/37/1039003637.db2.gz DSBDKBGFJGGHSZ-XJKSGUPXSA-N 1 1 346.452 4.059 20 5 EIBDMO Cc1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)C3(CCC3)C2)cc1[N+](=O)[O-] ZINC000555349760 1039090858 /nfs/dbraw/zinc/09/08/58/1039090858.db2.gz WFKZIQNSPBHTLL-OAHLLOKOSA-N 1 1 342.361 4.458 20 5 EIBDMO CO[C@H](C[N@@H+](C)Cc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000513896572 1039355318 /nfs/dbraw/zinc/35/53/18/1039355318.db2.gz ATZQANUUMROEBR-QGZVFWFLSA-N 1 1 334.803 4.068 20 5 EIBDMO Cc1ccccc1C[C@@H]1CCC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000514184961 1039705836 /nfs/dbraw/zinc/70/58/36/1039705836.db2.gz AWDBEIYYKCDMJR-INIZCTEOSA-N 1 1 328.387 4.249 20 5 EIBDMO CC(C)C[C@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000534842742 1039817433 /nfs/dbraw/zinc/81/74/33/1039817433.db2.gz KKOVDEZPOXAIJX-CQSZACIVSA-N 1 1 329.400 4.118 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCCC4(CCCCC4)C3)nc2c1 ZINC000435059869 1040040104 /nfs/dbraw/zinc/04/01/04/1040040104.db2.gz QQMMNKRVDOAYLQ-UHFFFAOYSA-N 1 1 329.400 4.282 20 5 EIBDMO C[C@H]([NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1ccncc1F ZINC000510028727 1040121439 /nfs/dbraw/zinc/12/14/39/1040121439.db2.gz YYJWLRSNPFYGLQ-LBPRGKRZSA-N 1 1 341.342 4.240 20 5 EIBDMO CC[N@@H+](Cc1c[nH]c2ccccc12)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000442893525 1040374264 /nfs/dbraw/zinc/37/42/64/1040374264.db2.gz SINPSNALIZGKHG-UHFFFAOYSA-N 1 1 339.395 4.107 20 5 EIBDMO CCC[C@H](N[C@@H]1CC[N@@H+](C2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000482638606 1040403248 /nfs/dbraw/zinc/40/32/48/1040403248.db2.gz BHPDNUFWTLSHPH-APWZRJJASA-N 1 1 331.460 4.043 20 5 EIBDMO CCC[C@H](N[C@@H]1CC[N@H+](C2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000482638606 1040403254 /nfs/dbraw/zinc/40/32/54/1040403254.db2.gz BHPDNUFWTLSHPH-APWZRJJASA-N 1 1 331.460 4.043 20 5 EIBDMO CC[C@@H](C)C[N@@H+](CC)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000160552361 1040594932 /nfs/dbraw/zinc/59/49/32/1040594932.db2.gz ZMUMNLQRPFLOKV-OLZOCXBDSA-N 1 1 332.404 4.074 20 5 EIBDMO C[C@H](O)C[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000539828620 1040821979 /nfs/dbraw/zinc/82/19/79/1040821979.db2.gz FGJNXXVXICONTJ-KBPBESRZSA-N 1 1 346.452 4.059 20 5 EIBDMO C[C@@H](NC[C@H]1CCC[N@H+]1C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000436286759 1041040442 /nfs/dbraw/zinc/04/04/42/1041040442.db2.gz BBWJVWFBDSZYNO-DNVCBOLYSA-N 1 1 331.460 4.043 20 5 EIBDMO COc1ccc2c(c1)CCC[C@@H]2[N@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505786115 1041048571 /nfs/dbraw/zinc/04/85/71/1041048571.db2.gz YDECIJUVRMQETP-SFHVURJKSA-N 1 1 344.386 4.252 20 5 EIBDMO COc1ccc2c(c1)CCC[C@@H]2[N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505786115 1041048578 /nfs/dbraw/zinc/04/85/78/1041048578.db2.gz YDECIJUVRMQETP-SFHVURJKSA-N 1 1 344.386 4.252 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+][C@@H]2c3ccc(F)cc3O[C@H]2C)cc1[N+](=O)[O-] ZINC000554374089 1041058471 /nfs/dbraw/zinc/05/84/71/1041058471.db2.gz POPOTGAZFYJXDG-PZROIBLQSA-N 1 1 330.359 4.215 20 5 EIBDMO C[C@H]([NH2+]Cc1cc(-c2ccc(F)cc2)no1)c1cccc([N+](=O)[O-])c1 ZINC000538178070 1041133082 /nfs/dbraw/zinc/13/30/82/1041133082.db2.gz PKRXSGIXBQTAIO-LBPRGKRZSA-N 1 1 341.342 4.240 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425554047 1041249901 /nfs/dbraw/zinc/24/99/01/1041249901.db2.gz NVNCMZAVJALWFT-KXBFYZLASA-N 1 1 344.455 4.245 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](COc2ccccc2)C1 ZINC000505880237 1041475605 /nfs/dbraw/zinc/47/56/05/1041475605.db2.gz RLNRIGYVHQZZCO-CVEARBPZSA-N 1 1 326.396 4.057 20 5 EIBDMO CC[C@]1(C)CCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000538736704 1041508203 /nfs/dbraw/zinc/50/82/03/1041508203.db2.gz XXKXDHZZEHNHMR-LJQANCHMSA-N 1 1 342.443 4.007 20 5 EIBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463456157 1041576835 /nfs/dbraw/zinc/57/68/35/1041576835.db2.gz YXXZREMCVKAZPT-CABCVRRESA-N 1 1 346.349 4.027 20 5 EIBDMO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1cc(F)c(F)c(F)c1 ZINC000540768202 1041657824 /nfs/dbraw/zinc/65/78/24/1041657824.db2.gz GZZYONASFSJILA-XQRVVYSFSA-N 1 1 336.313 4.157 20 5 EIBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1cc(F)c(F)c(F)c1 ZINC000540768202 1041657829 /nfs/dbraw/zinc/65/78/29/1041657829.db2.gz GZZYONASFSJILA-XQRVVYSFSA-N 1 1 336.313 4.157 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCS[C@H]2CCCC[C@H]21 ZINC000437535031 1041833678 /nfs/dbraw/zinc/83/36/78/1041833678.db2.gz KFKWOFLDQSFYPX-HIFRSBDPSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCS[C@H]2CCCC[C@H]21 ZINC000437535031 1041833680 /nfs/dbraw/zinc/83/36/80/1041833680.db2.gz KFKWOFLDQSFYPX-HIFRSBDPSA-N 1 1 326.849 4.108 20 5 EIBDMO COc1cccc(F)c1[C@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000122438132 1041956833 /nfs/dbraw/zinc/95/68/33/1041956833.db2.gz TVVWSUGZMGQGKD-OLZOCXBDSA-N 1 1 332.375 4.463 20 5 EIBDMO COc1ccc2c(c1)CCC[N@@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000609133850 1042059072 /nfs/dbraw/zinc/05/90/72/1042059072.db2.gz BWQJQFZYNQJRFU-CQSZACIVSA-N 1 1 326.396 4.113 20 5 EIBDMO CCc1cnccc1[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000542123911 1042291857 /nfs/dbraw/zinc/29/18/57/1042291857.db2.gz TXMNOSBGMSAGTL-AWEZNQCLSA-N 1 1 343.427 4.190 20 5 EIBDMO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000491856246 1042508258 /nfs/dbraw/zinc/50/82/58/1042508258.db2.gz AHXBLGVOKVTAAR-GOSISDBHSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000491856246 1042508260 /nfs/dbraw/zinc/50/82/60/1042508260.db2.gz AHXBLGVOKVTAAR-GOSISDBHSA-N 1 1 330.359 4.080 20 5 EIBDMO CC[C@@H]([NH2+]C1(c2nc(C)cs2)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000271958397 1042561547 /nfs/dbraw/zinc/56/15/47/1042561547.db2.gz KTVBZVHTNWXYHF-OAHLLOKOSA-N 1 1 331.441 4.480 20 5 EIBDMO C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCS1 ZINC000426390835 1042633756 /nfs/dbraw/zinc/63/37/56/1042633756.db2.gz MBOIWDYIJLKXNX-CYBMUJFWSA-N 1 1 332.425 4.182 20 5 EIBDMO CCOc1cc(C[N@@H+]2CCCC[C@@H]2c2cccn2C)ccc1[N+](=O)[O-] ZINC000492658140 1042720141 /nfs/dbraw/zinc/72/01/41/1042720141.db2.gz UNCPWZMQOXQWDY-QGZVFWFLSA-N 1 1 343.427 4.059 20 5 EIBDMO CCOc1cc(C[N@H+]2CCCC[C@@H]2c2cccn2C)ccc1[N+](=O)[O-] ZINC000492658140 1042720151 /nfs/dbraw/zinc/72/01/51/1042720151.db2.gz UNCPWZMQOXQWDY-QGZVFWFLSA-N 1 1 343.427 4.059 20 5 EIBDMO CCOc1cc(C[N@H+]2CC[C@H](C(F)(F)F)C2(C)C)ccc1[N+](=O)[O-] ZINC000493573995 1042936511 /nfs/dbraw/zinc/93/65/11/1042936511.db2.gz RIGQPLNHGYIUDC-AWEZNQCLSA-N 1 1 346.349 4.156 20 5 EIBDMO CCOc1cc(C[N@H+]2CC[C@@H](C(F)(F)F)C2(C)C)ccc1[N+](=O)[O-] ZINC000493573996 1042936821 /nfs/dbraw/zinc/93/68/21/1042936821.db2.gz RIGQPLNHGYIUDC-CQSZACIVSA-N 1 1 346.349 4.156 20 5 EIBDMO CC[N@@H+](Cc1ccc(C(C)C)c([N+](=O)[O-])c1)[C@@H]1CCOC(C)(C)C1 ZINC000579537325 1042956858 /nfs/dbraw/zinc/95/68/58/1042956858.db2.gz CYNVLOYIPGUABA-MRXNPFEDSA-N 1 1 334.460 4.498 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@H]3/C=C/c3ccccc3)nc2c1 ZINC000611554675 1043046621 /nfs/dbraw/zinc/04/66/21/1043046621.db2.gz RVMCKORUPPJBLA-FDMDGMSGSA-N 1 1 349.390 4.414 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H]3/C=C/c3ccccc3)nc2c1 ZINC000611554675 1043046631 /nfs/dbraw/zinc/04/66/31/1043046631.db2.gz RVMCKORUPPJBLA-FDMDGMSGSA-N 1 1 349.390 4.414 20 5 EIBDMO COCCCC[N@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000065166761 1043281781 /nfs/dbraw/zinc/28/17/81/1043281781.db2.gz HDPDMXZDZXDVKB-UHFFFAOYSA-N 1 1 334.441 4.085 20 5 EIBDMO COCCCC[N@@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000065166761 1043281789 /nfs/dbraw/zinc/28/17/89/1043281789.db2.gz HDPDMXZDZXDVKB-UHFFFAOYSA-N 1 1 334.441 4.085 20 5 EIBDMO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000078968926 1043819253 /nfs/dbraw/zinc/81/92/53/1043819253.db2.gz LAKIECURDQTVIV-QWHCGFSZSA-N 1 1 330.384 4.024 20 5 EIBDMO COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000078968909 1043819370 /nfs/dbraw/zinc/81/93/70/1043819370.db2.gz LAKIECURDQTVIV-STQMWFEESA-N 1 1 330.384 4.024 20 5 EIBDMO C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])c3cnccc23)[C@@H]1c1ccccc1 ZINC000301854518 1043820656 /nfs/dbraw/zinc/82/06/56/1043820656.db2.gz YITFKBCLZGQXKC-QUCCMNQESA-N 1 1 348.406 4.000 20 5 EIBDMO Cc1c(C[N@@H+]2[C@H](C)CO[C@H](c3ccccc3)[C@H]2C)cccc1[N+](=O)[O-] ZINC000731892663 1043840353 /nfs/dbraw/zinc/84/03/53/1043840353.db2.gz JGBHDSBDQFBTPI-KKVAFCGZSA-N 1 1 340.423 4.254 20 5 EIBDMO Cc1c(C[N@H+]2[C@H](C)CO[C@H](c3ccccc3)[C@H]2C)cccc1[N+](=O)[O-] ZINC000731892663 1043840357 /nfs/dbraw/zinc/84/03/57/1043840357.db2.gz JGBHDSBDQFBTPI-KKVAFCGZSA-N 1 1 340.423 4.254 20 5 EIBDMO CC(C)C[C@H]1CC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000245493713 1043938273 /nfs/dbraw/zinc/93/82/73/1043938273.db2.gz MBISVYMQXASIIU-ZIAGYGMSSA-N 1 1 344.415 4.074 20 5 EIBDMO Cc1nn(C)c(C)c1[C@@H]1CCC[N@@H+]1[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000245531625 1043971588 /nfs/dbraw/zinc/97/15/88/1043971588.db2.gz TZTUQCMZKUJFAI-KDOFPFPSSA-N 1 1 342.443 4.152 20 5 EIBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@@H](C)C1 ZINC000443065987 1043985115 /nfs/dbraw/zinc/98/51/15/1043985115.db2.gz BRIURUOONOGOSR-UONOGXRCSA-N 1 1 346.452 4.323 20 5 EIBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Br)c1ccccc1 ZINC001168473321 1044475789 /nfs/dbraw/zinc/47/57/89/1044475789.db2.gz CRLUYGUBNUKPRW-NSHDSACASA-N 1 1 335.201 4.208 20 5 EIBDMO C[C@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1ccc([N+](=O)[O-])cc1 ZINC000154642583 1044821371 /nfs/dbraw/zinc/82/13/71/1044821371.db2.gz AAFSEUMQDQGXGA-MGPUTAFESA-N 1 1 333.391 4.430 20 5 EIBDMO COC[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000093337700 1044831982 /nfs/dbraw/zinc/83/19/82/1044831982.db2.gz BVRZPLXOAYIEAN-AWEZNQCLSA-N 1 1 346.452 4.182 20 5 EIBDMO CSC[C@@H]1CCC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000093760657 1044853283 /nfs/dbraw/zinc/85/32/83/1044853283.db2.gz YYIKGMYHZBSNRV-HNNXBMFYSA-N 1 1 349.481 4.046 20 5 EIBDMO C[C@@H](Cc1ccc(Cl)cc1)[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000736624123 1044958684 /nfs/dbraw/zinc/95/86/84/1044958684.db2.gz XTLGVGVWVDGUPL-LBPRGKRZSA-N 1 1 336.794 4.450 20 5 EIBDMO Cc1nn(C[N@H+]2CCC[C@@H](C)[C@H]2c2ccc(C)cc2)c(C)c1[N+](=O)[O-] ZINC000738284647 1045047129 /nfs/dbraw/zinc/04/71/29/1045047129.db2.gz MXGUXHQZFHGNBE-KDOFPFPSSA-N 1 1 342.443 4.147 20 5 EIBDMO Cc1nn(C[N@@H+]2CCC[C@@H](C)[C@H]2c2ccc(C)cc2)c(C)c1[N+](=O)[O-] ZINC000738284647 1045047139 /nfs/dbraw/zinc/04/71/39/1045047139.db2.gz MXGUXHQZFHGNBE-KDOFPFPSSA-N 1 1 342.443 4.147 20 5 EIBDMO CC[C@H](c1ccc(F)cc1)[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000738298303 1045055036 /nfs/dbraw/zinc/05/50/36/1045055036.db2.gz HYTLFGRNBWKVES-QGZVFWFLSA-N 1 1 343.402 4.007 20 5 EIBDMO Cc1cccc(NC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c1[N+](=O)[O-] ZINC000302490423 1045180072 /nfs/dbraw/zinc/18/00/72/1045180072.db2.gz JVOIPEWWYHTLLN-KDOFPFPSSA-N 1 1 345.468 4.460 20 5 EIBDMO CCOc1ccc([C@H](C)[NH2+][C@H](CCOC)c2ccco2)cc1[N+](=O)[O-] ZINC000272487853 1045491844 /nfs/dbraw/zinc/49/18/44/1045491844.db2.gz BXEPPBCZFDCEQQ-DZGCQCFKSA-N 1 1 348.399 4.015 20 5 EIBDMO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1cccc([N+](=O)[O-])c1)CCC2 ZINC000152455565 1045750599 /nfs/dbraw/zinc/75/05/99/1045750599.db2.gz CAGQIOCNIGQFCH-OAHLLOKOSA-N 1 1 331.441 4.123 20 5 EIBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H]1CCOc2ccccc21 ZINC000768214495 1045754755 /nfs/dbraw/zinc/75/47/55/1045754755.db2.gz BPFVAYRWMZBPSC-CYBMUJFWSA-N 1 1 346.814 4.246 20 5 EIBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)cc1 ZINC000768541516 1045817799 /nfs/dbraw/zinc/81/77/99/1045817799.db2.gz IGJJYZXNAMYPLC-OAHLLOKOSA-N 1 1 346.814 4.246 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+](C[C@H]2CCCO2)C2CCCC2)ccc1Cl ZINC000768555250 1045819499 /nfs/dbraw/zinc/81/94/99/1045819499.db2.gz PBKHQCIBPIECSQ-OAHLLOKOSA-N 1 1 338.835 4.172 20 5 EIBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000768548857 1045823085 /nfs/dbraw/zinc/82/30/85/1045823085.db2.gz ILAXJXXZGYKKJD-OLZOCXBDSA-N 1 1 328.865 4.354 20 5 EIBDMO CC[N@@H+](Cc1ccccc1)[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170329376 1046000927 /nfs/dbraw/zinc/00/09/27/1046000927.db2.gz PPMBYHAZKQKNES-HNNXBMFYSA-N 1 1 328.412 4.057 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCCC[C@H]2c2ccco2)c([N+](=O)[O-])c1 ZINC000792868293 1046082060 /nfs/dbraw/zinc/08/20/60/1046082060.db2.gz SVMRKDPEASGBRZ-HNNXBMFYSA-N 1 1 345.355 4.213 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCCC[C@H]2c2ccco2)c([N+](=O)[O-])c1 ZINC000792868293 1046082076 /nfs/dbraw/zinc/08/20/76/1046082076.db2.gz SVMRKDPEASGBRZ-HNNXBMFYSA-N 1 1 345.355 4.213 20 5 EIBDMO CCOc1ccc([C@H](C)[NH2+]Cc2ccccc2Cl)cc1[N+](=O)[O-] ZINC000152515117 1046096289 /nfs/dbraw/zinc/09/62/89/1046096289.db2.gz FOLLSOVZBWOEKW-LBPRGKRZSA-N 1 1 334.803 4.498 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3ccc(CF)cc3)C2)cc1 ZINC001170423884 1046121831 /nfs/dbraw/zinc/12/18/31/1046121831.db2.gz JUYZXDMXKZTJJB-SFHVURJKSA-N 1 1 328.387 4.444 20 5 EIBDMO C[C@H](CCO)[N@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000772380796 1046630213 /nfs/dbraw/zinc/63/02/13/1046630213.db2.gz DWYXOEUXYCXIOH-CQSZACIVSA-N 1 1 348.830 4.021 20 5 EIBDMO C[C@H](CCO)[N@@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000772380796 1046630219 /nfs/dbraw/zinc/63/02/19/1046630219.db2.gz DWYXOEUXYCXIOH-CQSZACIVSA-N 1 1 348.830 4.021 20 5 EIBDMO Cc1cc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c(C)o1 ZINC000785521290 1046703669 /nfs/dbraw/zinc/70/36/69/1046703669.db2.gz IMDPQJNXNMNUFH-UHFFFAOYSA-N 1 1 328.290 4.113 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000746663576 1046963325 /nfs/dbraw/zinc/96/33/25/1046963325.db2.gz RHEUJTRBTTUZAD-INIZCTEOSA-N 1 1 332.787 4.291 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000746663576 1046963344 /nfs/dbraw/zinc/96/33/44/1046963344.db2.gz RHEUJTRBTTUZAD-INIZCTEOSA-N 1 1 332.787 4.291 20 5 EIBDMO CC[C@H](c1ccccc1)[C@H]1CCC[N@H+]1Cn1nc(C)c([N+](=O)[O-])c1C ZINC000746713914 1047068959 /nfs/dbraw/zinc/06/89/59/1047068959.db2.gz YEFZBLUHBBERQE-QZTJIDSGSA-N 1 1 342.443 4.024 20 5 EIBDMO C[C@@H]1SCC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H]1c1ccccc1 ZINC000788479881 1047197742 /nfs/dbraw/zinc/19/77/42/1047197742.db2.gz FLDVBHIPWLWRHT-UGSOOPFHSA-N 1 1 346.427 4.413 20 5 EIBDMO C[C@@H]1SCC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H]1c1ccccc1 ZINC000788479881 1047197750 /nfs/dbraw/zinc/19/77/50/1047197750.db2.gz FLDVBHIPWLWRHT-UGSOOPFHSA-N 1 1 346.427 4.413 20 5 EIBDMO C[C@H](N[C@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000556057311 1047419498 /nfs/dbraw/zinc/41/94/98/1047419498.db2.gz BDCLPSJVDWJVSO-ZAAXVRCTSA-N 1 1 339.439 4.081 20 5 EIBDMO C[C@H](N[C@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000556057311 1047419500 /nfs/dbraw/zinc/41/95/00/1047419500.db2.gz BDCLPSJVDWJVSO-ZAAXVRCTSA-N 1 1 339.439 4.081 20 5 EIBDMO COc1ccccc1[C@H]1CCCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000609280889 1047482562 /nfs/dbraw/zinc/48/25/62/1047482562.db2.gz UMQVXXWRCPJUBV-GOSISDBHSA-N 1 1 326.396 4.331 20 5 EIBDMO C[C@H](NCc1cc([O-])ccc1[N+](=O)[O-])c1csc2ccccc21 ZINC000763429510 1047529504 /nfs/dbraw/zinc/52/95/04/1047529504.db2.gz FNIWTVRHBWYGHJ-NSHDSACASA-N 1 1 328.393 4.366 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCCOc2c(Cl)cccc21 ZINC000089512214 1047788060 /nfs/dbraw/zinc/78/80/60/1047788060.db2.gz ZTBJHHQXSUMHEJ-HNNXBMFYSA-N 1 1 332.787 4.252 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cccnc3Cl)C2)cc1 ZINC000824820727 1047957890 /nfs/dbraw/zinc/95/78/90/1047957890.db2.gz LJHRFZVAMCRNFO-CQSZACIVSA-N 1 1 331.803 4.023 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)CCCN(C)Cc1ccco1 ZINC000556884584 1048098905 /nfs/dbraw/zinc/09/89/05/1048098905.db2.gz KCFMYYXPFAGFSS-INIZCTEOSA-N 1 1 345.443 4.011 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N(C)CCC[N@H+](C)Cc1ccco1 ZINC000556884584 1048098917 /nfs/dbraw/zinc/09/89/17/1048098917.db2.gz KCFMYYXPFAGFSS-INIZCTEOSA-N 1 1 345.443 4.011 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N(C)CCC[N@@H+](C)Cc1ccco1 ZINC000556884584 1048098930 /nfs/dbraw/zinc/09/89/30/1048098930.db2.gz KCFMYYXPFAGFSS-INIZCTEOSA-N 1 1 345.443 4.011 20 5 EIBDMO Cc1ccc2c(c1)C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C(C)(C)C2 ZINC001170560532 1048109350 /nfs/dbraw/zinc/10/93/50/1048109350.db2.gz VIMAVEKGDXNATR-UHFFFAOYSA-N 1 1 328.387 4.379 20 5 EIBDMO Cc1ccc2c(c1)C[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C(C)(C)C2 ZINC001170560532 1048109351 /nfs/dbraw/zinc/10/93/51/1048109351.db2.gz VIMAVEKGDXNATR-UHFFFAOYSA-N 1 1 328.387 4.379 20 5 EIBDMO CCCC(=O)C(=O)Nc1cc2[nH+]c3cc(N(C)C)ccc3cc2cc1C ZINC001144039738 1048387442 /nfs/dbraw/zinc/38/74/42/1048387442.db2.gz DCBVGWGZJMQXOQ-UHFFFAOYSA-N 1 1 349.434 4.070 20 5 EIBDMO Cc1ccncc1CCC[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000809541446 1048398405 /nfs/dbraw/zinc/39/84/05/1048398405.db2.gz UCLJSSKPXHGXRJ-UHFFFAOYSA-N 1 1 333.819 4.016 20 5 EIBDMO CCC[N@@H+](CCc1ccccn1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000809734495 1048484709 /nfs/dbraw/zinc/48/47/09/1048484709.db2.gz HTRWPAOUVUIJHG-UHFFFAOYSA-N 1 1 333.819 4.098 20 5 EIBDMO CC(C)[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C1CCOCC1 ZINC000809963482 1048572674 /nfs/dbraw/zinc/57/26/74/1048572674.db2.gz OTCAFXUYMANTIM-UHFFFAOYSA-N 1 1 347.242 4.291 20 5 EIBDMO C[C@@H]([NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])c1cccnc1 ZINC000809970507 1048576386 /nfs/dbraw/zinc/57/63/86/1048576386.db2.gz BIFWEBINMQFDCR-SECBINFHSA-N 1 1 326.183 4.147 20 5 EIBDMO Cc1ccncc1[C@H](C)[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809974518 1048583601 /nfs/dbraw/zinc/58/36/01/1048583601.db2.gz BHNWVUVGDHSKCE-JTQLQIEISA-N 1 1 340.210 4.456 20 5 EIBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+]1CCCCC[C@@H]1CCO ZINC000810011348 1048601788 /nfs/dbraw/zinc/60/17/88/1048601788.db2.gz IFUMAHFVZUDHJO-CYBMUJFWSA-N 1 1 347.242 4.029 20 5 EIBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@@H+]1CCCCC[C@@H]1CCO ZINC000810011348 1048601796 /nfs/dbraw/zinc/60/17/96/1048601796.db2.gz IFUMAHFVZUDHJO-CYBMUJFWSA-N 1 1 347.242 4.029 20 5 EIBDMO CC1(C)[C@H](c2ccccc2)CC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC001171266909 1049002548 /nfs/dbraw/zinc/00/25/48/1049002548.db2.gz LFPDCKWJYANVTP-KRWDZBQOSA-N 1 1 340.423 4.242 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC001171324521 1049286469 /nfs/dbraw/zinc/28/64/69/1049286469.db2.gz ZALOPAOTIVLTLC-JTQLQIEISA-N 1 1 336.741 4.413 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC001171324521 1049286483 /nfs/dbraw/zinc/28/64/83/1049286483.db2.gz ZALOPAOTIVLTLC-JTQLQIEISA-N 1 1 336.741 4.413 20 5 EIBDMO COCCCCc1ccc[nH+]c1NCc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000812345959 1049448328 /nfs/dbraw/zinc/44/83/28/1049448328.db2.gz YOOPHXAZDZGABY-UHFFFAOYSA-N 1 1 349.818 4.224 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCc2ccc(F)cc2[C@H](C)C1 ZINC001171670386 1049774566 /nfs/dbraw/zinc/77/45/66/1049774566.db2.gz DNZMJQAFRRKAJV-ZIAGYGMSSA-N 1 1 328.387 4.457 20 5 EIBDMO Cc1c(C[NH2+]C2(c3ccc(F)cc3F)CCC2)cccc1[N+](=O)[O-] ZINC000179990455 1049814131 /nfs/dbraw/zinc/81/41/31/1049814131.db2.gz YUQWAGKUWIKIOC-UHFFFAOYSA-N 1 1 332.350 4.350 20 5 EIBDMO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000216740716 1049851009 /nfs/dbraw/zinc/85/10/09/1049851009.db2.gz SSRNXUNOXUTESO-KRWDZBQOSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000216740716 1049851011 /nfs/dbraw/zinc/85/10/11/1049851011.db2.gz SSRNXUNOXUTESO-KRWDZBQOSA-N 1 1 330.359 4.080 20 5 EIBDMO CCOc1cc(C[N@@H+]2C[C@H](C(F)(F)F)CC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000617219572 1049970497 /nfs/dbraw/zinc/97/04/97/1049970497.db2.gz ZQRUYXONQXJGDF-WCQYABFASA-N 1 1 346.349 4.156 20 5 EIBDMO CCOc1cc(C[N@H+]2C[C@H](C(F)(F)F)CC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000617219572 1049970501 /nfs/dbraw/zinc/97/05/01/1049970501.db2.gz ZQRUYXONQXJGDF-WCQYABFASA-N 1 1 346.349 4.156 20 5 EIBDMO CC[NH+](CC)Cc1cccc(CNCc2cccc([N+](=O)[O-])c2C)c1 ZINC001177315284 1050189644 /nfs/dbraw/zinc/18/96/44/1050189644.db2.gz SLOAGEFTPVXXNK-UHFFFAOYSA-N 1 1 341.455 4.035 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCC[C@@H]1c1nccs1)CC2 ZINC001172920985 1050233358 /nfs/dbraw/zinc/23/33/58/1050233358.db2.gz NFEHZQREECSRBT-DOTOQJQBSA-N 1 1 343.452 4.136 20 5 EIBDMO C[N@@H+](Cc1ccc(F)cc1F)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172919611 1050234359 /nfs/dbraw/zinc/23/43/59/1050234359.db2.gz GUWRUNUGXQZYSE-KRWDZBQOSA-N 1 1 346.377 4.252 20 5 EIBDMO CCC(CC)[N@@H+](CC)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173194828 1050339890 /nfs/dbraw/zinc/33/98/90/1050339890.db2.gz AMHXLIGPCLNSQT-LBPRGKRZSA-N 1 1 326.412 4.184 20 5 EIBDMO COc1ccccc1[C@H]1CCC[N@H+]1[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173228384 1050357637 /nfs/dbraw/zinc/35/76/37/1050357637.db2.gz VUBKVNUUGZEYHH-DNVCBOLYSA-N 1 1 340.423 4.372 20 5 EIBDMO CC(C)[N@@H+](CC(=O)c1ccccc1)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173232829 1050359124 /nfs/dbraw/zinc/35/91/24/1050359124.db2.gz IENKMQVMYLLJNY-MRXNPFEDSA-N 1 1 340.423 4.119 20 5 EIBDMO COc1cccc([C@@H]2CC[N@H+]([C@@H](C)Cc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC001173231932 1050360348 /nfs/dbraw/zinc/36/03/48/1050360348.db2.gz OZKWTDOOHDYGQX-MAUKXSAKSA-N 1 1 340.423 4.024 20 5 EIBDMO O=[N+]([O-])c1ccccc1S[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001186757351 1050407311 /nfs/dbraw/zinc/40/73/11/1050407311.db2.gz SLRWMYYSJSESRV-MRXNPFEDSA-N 1 1 328.437 4.352 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2cc3cc(F)ccc3o2)c1 ZINC001178172080 1050407709 /nfs/dbraw/zinc/40/77/09/1050407709.db2.gz WGVDOCZEUCJGPL-UHFFFAOYSA-N 1 1 334.734 4.423 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1COc3c1cccc3Cl)CCC2 ZINC000618572021 1050413747 /nfs/dbraw/zinc/41/37/47/1050413747.db2.gz IJVSWVOZXSNTBN-SJORKVTESA-N 1 1 344.798 4.349 20 5 EIBDMO CC[C@@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])c1ccccc1OC ZINC000775085163 1050482940 /nfs/dbraw/zinc/48/29/40/1050482940.db2.gz XOJSAOKGCXWTMV-OAHLLOKOSA-N 1 1 334.803 4.498 20 5 EIBDMO Cc1cccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cc3Cl)C2)c1 ZINC001187189745 1050499040 /nfs/dbraw/zinc/49/90/40/1050499040.db2.gz HHESHNAKOPMDFN-OAHLLOKOSA-N 1 1 345.830 4.243 20 5 EIBDMO CC(C)c1cc(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)on1 ZINC000618984249 1050611980 /nfs/dbraw/zinc/61/19/80/1050611980.db2.gz FCKMUUVGVULUAE-QGZVFWFLSA-N 1 1 329.400 4.218 20 5 EIBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)C/C(C)=C/c2cccc([N+](=O)[O-])c2)C12CCC2 ZINC001180132858 1050882526 /nfs/dbraw/zinc/88/25/26/1050882526.db2.gz NROXLBCEIQWAHL-JIEALELQSA-N 1 1 344.455 4.278 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCc2ccc(Cl)cc2C1 ZINC001180219017 1050918108 /nfs/dbraw/zinc/91/81/08/1050918108.db2.gz IKCQXEDPMWMMSV-UHFFFAOYSA-N 1 1 330.815 4.423 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCc2ccc(Cl)cc2C1 ZINC001180219017 1050918121 /nfs/dbraw/zinc/91/81/21/1050918121.db2.gz IKCQXEDPMWMMSV-UHFFFAOYSA-N 1 1 330.815 4.423 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H](c2ccc(F)c(F)c2)C1 ZINC001174844852 1051207208 /nfs/dbraw/zinc/20/72/08/1051207208.db2.gz ICRJJDTYWAXIKH-CQSZACIVSA-N 1 1 332.350 4.253 20 5 EIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(C(F)F)c(F)c1 ZINC001181697836 1051290888 /nfs/dbraw/zinc/29/08/88/1051290888.db2.gz OFENDDWUBPRBTK-UHFFFAOYSA-N 1 1 338.329 4.346 20 5 EIBDMO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1cc([N+](=O)[O-])ccc1Br ZINC001190865494 1051296709 /nfs/dbraw/zinc/29/67/09/1051296709.db2.gz VSWXVCPVYOSEJX-PHIMTYICSA-N 1 1 327.222 4.120 20 5 EIBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1cc([N+](=O)[O-])ccc1Br ZINC001190865494 1051296722 /nfs/dbraw/zinc/29/67/22/1051296722.db2.gz VSWXVCPVYOSEJX-PHIMTYICSA-N 1 1 327.222 4.120 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C(C)C)C1CCCCC1 ZINC001191870799 1051576710 /nfs/dbraw/zinc/57/67/10/1051576710.db2.gz LPHLCNDMZIMNHI-UHFFFAOYSA-N 1 1 347.459 4.275 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC=C(c2cccc(C)c2)CC1 ZINC001192557136 1051759244 /nfs/dbraw/zinc/75/92/44/1051759244.db2.gz MXUKBWOGUFVRMI-UHFFFAOYSA-N 1 1 338.407 4.201 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC=C(c2cccc(C)c2)CC1 ZINC001192557136 1051759260 /nfs/dbraw/zinc/75/92/60/1051759260.db2.gz MXUKBWOGUFVRMI-UHFFFAOYSA-N 1 1 338.407 4.201 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2c3ccccc3cc3ccccc32)CC[S@](=O)C1 ZINC000763651399 1051812502 /nfs/dbraw/zinc/81/25/02/1051812502.db2.gz ICGHBXJWXPOZNN-GYCJOSAFSA-N 1 1 337.488 4.193 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@]1(C)Cc1ccccc1 ZINC001193066292 1051860079 /nfs/dbraw/zinc/86/00/79/1051860079.db2.gz BBHJTUPDHRVRAS-FQEVSTJZSA-N 1 1 340.423 4.201 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC001193055543 1051867513 /nfs/dbraw/zinc/86/75/13/1051867513.db2.gz XSJJLCMPNRXITI-GOSISDBHSA-N 1 1 326.396 4.331 20 5 EIBDMO C[C@@H]1CC[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)[C@H]1c1ccccc1 ZINC001176035789 1051881668 /nfs/dbraw/zinc/88/16/68/1051881668.db2.gz CUVIIQFBRXUUPT-KZULUSFZSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@@H]1CC[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)[C@H]1c1ccccc1 ZINC001176035789 1051881670 /nfs/dbraw/zinc/88/16/70/1051881670.db2.gz CUVIIQFBRXUUPT-KZULUSFZSA-N 1 1 332.350 4.456 20 5 EIBDMO Cc1cccc([C@@H]2CC[N@H+](Cc3c(F)cc([N+](=O)[O-])cc3F)C2)c1 ZINC001193322490 1051899810 /nfs/dbraw/zinc/89/98/10/1051899810.db2.gz BZCJYAATQYATKL-CQSZACIVSA-N 1 1 332.350 4.171 20 5 EIBDMO Cc1cccc([C@@H]2CC[N@@H+](Cc3c(F)cc([N+](=O)[O-])cc3F)C2)c1 ZINC001193322490 1051899816 /nfs/dbraw/zinc/89/98/16/1051899816.db2.gz BZCJYAATQYATKL-CQSZACIVSA-N 1 1 332.350 4.171 20 5 EIBDMO CCC[C@@]1(COC)CCC[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC001193872953 1052020904 /nfs/dbraw/zinc/02/09/04/1052020904.db2.gz PSIDEVUNQWZESK-INIZCTEOSA-N 1 1 326.824 4.029 20 5 EIBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1cc(Cl)ccc1[N+](=O)[O-] ZINC001184874570 1052122498 /nfs/dbraw/zinc/12/24/98/1052122498.db2.gz QYWBLHHSYKYBQL-CYBMUJFWSA-N 1 1 325.840 4.315 20 5 EIBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H]1CCCc2ccccc21 ZINC000774820121 1052168720 /nfs/dbraw/zinc/16/87/20/1052168720.db2.gz WDAHWBFIDWCHKB-KRWDZBQOSA-N 1 1 341.367 4.012 20 5 EIBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H]1CCCc2ccccc21 ZINC000774820121 1052168725 /nfs/dbraw/zinc/16/87/25/1052168725.db2.gz WDAHWBFIDWCHKB-KRWDZBQOSA-N 1 1 341.367 4.012 20 5 EIBDMO Cc1cccc([C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1 ZINC000774831277 1052179215 /nfs/dbraw/zinc/17/92/15/1052179215.db2.gz FCDPNZYVMMKOEX-QGZVFWFLSA-N 1 1 341.367 4.149 20 5 EIBDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1 ZINC000774831277 1052179221 /nfs/dbraw/zinc/17/92/21/1052179221.db2.gz FCDPNZYVMMKOEX-QGZVFWFLSA-N 1 1 341.367 4.149 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(N2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)c1 ZINC001185701499 1052284454 /nfs/dbraw/zinc/28/44/54/1052284454.db2.gz IVKJKPPYZDQINK-KRWDZBQOSA-N 1 1 345.487 4.384 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000072558852 1052434484 /nfs/dbraw/zinc/43/44/84/1052434484.db2.gz UVVUDFSGJAUYSF-CQSZACIVSA-N 1 1 348.406 4.321 20 5 EIBDMO C[C@@H]1C[C@H](C(C)(C)C)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001194807733 1053109220 /nfs/dbraw/zinc/10/92/20/1053109220.db2.gz SYHXDVPNABPRAG-HUUCEWRRSA-N 1 1 347.459 4.070 20 5 EIBDMO C[N@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1C[C@H](Oc2ccccc2)C1(C)C ZINC001194881563 1053139327 /nfs/dbraw/zinc/13/93/27/1053139327.db2.gz ALVIRISBXTUKQK-CVEARBPZSA-N 1 1 346.452 4.334 20 5 EIBDMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1C[C@H](Oc2ccccc2)C1(C)C ZINC001194881563 1053139339 /nfs/dbraw/zinc/13/93/39/1053139339.db2.gz ALVIRISBXTUKQK-CVEARBPZSA-N 1 1 346.452 4.334 20 5 EIBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000794685299 1053265903 /nfs/dbraw/zinc/26/59/03/1053265903.db2.gz ORGTVIQCPCSIRN-CQSZACIVSA-N 1 1 343.383 4.475 20 5 EIBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@@H]1CCCC[C@@H]1c1ccccc1 ZINC001195156817 1053307842 /nfs/dbraw/zinc/30/78/42/1053307842.db2.gz ZORVMXAICLARRW-QZTJIDSGSA-N 1 1 325.412 4.148 20 5 EIBDMO COc1cc(C[N@H+]2CCCC3(CCCC3)CC2)c([N+](=O)[O-])cc1F ZINC001196040028 1053568725 /nfs/dbraw/zinc/56/87/25/1053568725.db2.gz TZJHCNJQBGHGOG-UHFFFAOYSA-N 1 1 336.407 4.289 20 5 EIBDMO CC(C)c1ccc(C[NH2+]Cc2noc3cc(F)ccc23)cc1[N+](=O)[O-] ZINC000865835636 1053605976 /nfs/dbraw/zinc/60/59/76/1053605976.db2.gz DOPLVZPWVGTQIE-UHFFFAOYSA-N 1 1 343.358 4.288 20 5 EIBDMO C[C@@H]([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)c1ccc2c(c1)CCCO2 ZINC000852779879 1053609941 /nfs/dbraw/zinc/60/99/41/1053609941.db2.gz GCQBLLAZYWWXME-LLVKDONJSA-N 1 1 348.349 4.049 20 5 EIBDMO C[C@H](C[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC001196818362 1053779620 /nfs/dbraw/zinc/77/96/20/1053779620.db2.gz JICIULQDQRRDIW-OAHLLOKOSA-N 1 1 347.459 4.072 20 5 EIBDMO O=[N+]([O-])c1ncccc1C[NH+]1CCC(Cc2ccccc2Cl)CC1 ZINC001197020197 1053826555 /nfs/dbraw/zinc/82/65/55/1053826555.db2.gz BIEAMMOZZHCSKC-UHFFFAOYSA-N 1 1 345.830 4.098 20 5 EIBDMO C[C@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])c1ccc([N+](=O)[O-])cc1 ZINC001197661447 1053963370 /nfs/dbraw/zinc/96/33/70/1053963370.db2.gz WDSZGCAYVCDBER-JTQLQIEISA-N 1 1 335.747 4.007 20 5 EIBDMO CC[C@H](C[N@@H+](CC)C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000775895280 1054278572 /nfs/dbraw/zinc/27/85/72/1054278572.db2.gz KZCBEYIBUICLPJ-OXQOHEQNSA-N 1 1 342.439 4.144 20 5 EIBDMO CC[C@H](C[N@@H+](CC)C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000775895886 1054280326 /nfs/dbraw/zinc/28/03/26/1054280326.db2.gz OYWFMUPHHUHFPD-OXQOHEQNSA-N 1 1 342.439 4.144 20 5 EIBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc(Cl)nc1 ZINC000872025740 1054340409 /nfs/dbraw/zinc/34/04/09/1054340409.db2.gz SHOFXVDTOBYTJT-SNVBAGLBSA-N 1 1 337.832 4.216 20 5 EIBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)c1c(C)noc1C ZINC000872035169 1054349111 /nfs/dbraw/zinc/34/91/11/1054349111.db2.gz NJRXIUJVRMTDPC-NXEZZACHSA-N 1 1 335.429 4.333 20 5 EIBDMO COc1cccc2c1CC[C@H]2[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872043464 1054356478 /nfs/dbraw/zinc/35/64/78/1054356478.db2.gz ICCBIGXAMJCPKP-IAQYHMDHSA-N 1 1 330.359 4.081 20 5 EIBDMO Cc1nc2c(s1)[C@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])CCC2 ZINC000872060206 1054370949 /nfs/dbraw/zinc/37/09/49/1054370949.db2.gz NUZZAHYVFZYDQQ-JOYOIKCWSA-N 1 1 335.404 4.227 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H](c2ccccn2)C2CCC2)c1 ZINC000858239802 1054444783 /nfs/dbraw/zinc/44/47/83/1054444783.db2.gz XHYSFVDURSLPKR-QGZVFWFLSA-N 1 1 331.803 4.274 20 5 EIBDMO C[C@]1(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1(Cl)Cl ZINC000828428122 1054784398 /nfs/dbraw/zinc/78/43/98/1054784398.db2.gz INXMDXRGDXJRKQ-CQSZACIVSA-N 1 1 329.227 4.143 20 5 EIBDMO C[C@]1(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1(Cl)Cl ZINC000828428122 1054784413 /nfs/dbraw/zinc/78/44/13/1054784413.db2.gz INXMDXRGDXJRKQ-CQSZACIVSA-N 1 1 329.227 4.143 20 5 EIBDMO C[C@@H]([NH2+][C@@H](C)c1nc2c(s1)CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000173427195 1054937365 /nfs/dbraw/zinc/93/73/65/1054937365.db2.gz KMFLOEXCJHXUKM-NEPJUHHUSA-N 1 1 331.441 4.342 20 5 EIBDMO CCn1c2ccccc2nc1[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000173428792 1054951128 /nfs/dbraw/zinc/95/11/28/1054951128.db2.gz QBXDHHIYXXSDRC-ZIAGYGMSSA-N 1 1 338.411 4.376 20 5 EIBDMO Cc1csc([C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)n1 ZINC000877815008 1055128156 /nfs/dbraw/zinc/12/81/56/1055128156.db2.gz ZQGNKTJERFPHND-LBPRGKRZSA-N 1 1 337.832 4.003 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2ccc(CNc3ccc4[nH]c[nH+]c4c3)o2)c1 ZINC001202350097 1055137243 /nfs/dbraw/zinc/13/72/43/1055137243.db2.gz QEMSQCJAYBBFQO-UHFFFAOYSA-N 1 1 334.335 4.343 20 5 EIBDMO CC(C)[N@H+](Cc1cccc(Cl)c1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776273769 1055139594 /nfs/dbraw/zinc/13/95/94/1055139594.db2.gz AFWDALSJDZILHA-SFHVURJKSA-N 1 1 348.830 4.192 20 5 EIBDMO C[N@H+]1CCC[C@H](CNc2ccc(F)cc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000301452233 1055256574 /nfs/dbraw/zinc/25/65/74/1055256574.db2.gz XSKIKSHZIURAJH-PXAZEXFGSA-N 1 1 349.431 4.290 20 5 EIBDMO Cc1c([C@@H](C)[NH2+]Cc2cn3cc(Cl)ccc3n2)cccc1[N+](=O)[O-] ZINC000131570053 1055432871 /nfs/dbraw/zinc/43/28/71/1055432871.db2.gz UJMKOOLOAJGJOS-GFCCVEGCSA-N 1 1 344.802 4.055 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1NC[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000301484948 1055591587 /nfs/dbraw/zinc/59/15/87/1055591587.db2.gz WCARNSIOQNZZFF-KDOFPFPSSA-N 1 1 345.468 4.460 20 5 EIBDMO Cc1c(C[NH2+]Cc2cscc2Br)cccc1[N+](=O)[O-] ZINC000388037867 1056199091 /nfs/dbraw/zinc/19/90/91/1056199091.db2.gz YCZNVPUMIUCPGW-UHFFFAOYSA-N 1 1 341.230 4.017 20 5 EIBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[NH+]2CCCCC2)cc1OC ZINC001169451097 1060819804 /nfs/dbraw/zinc/81/98/04/1060819804.db2.gz DVBDOPOACONJSG-AWEZNQCLSA-N 1 1 336.432 4.014 20 5 EIBDMO CC(=O)Nc1cccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000237606445 1032064670 /nfs/dbraw/zinc/06/46/70/1032064670.db2.gz RPTXRHGIEBFRPL-NSHDSACASA-N 1 1 347.802 4.057 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)c1ccc(F)cc1Cl ZINC000430201001 1019254696 /nfs/dbraw/zinc/25/46/96/1019254696.db2.gz BLQSQLWQZOGSDA-JTQLQIEISA-N 1 1 338.766 4.247 20 5 EIBDMO COc1ccc(C[C@@H]2CCC[N@@H+](Cc3csc([N+](=O)[O-])c3)C2)cc1 ZINC000610215689 1019389271 /nfs/dbraw/zinc/38/92/71/1019389271.db2.gz VUILFGGCTBEEKY-HNNXBMFYSA-N 1 1 346.452 4.120 20 5 EIBDMO Cc1ccccc1OCCC[N@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC001167084238 1019749469 /nfs/dbraw/zinc/74/94/69/1019749469.db2.gz MFWBIYLYSVZTAH-UHFFFAOYSA-N 1 1 348.830 4.458 20 5 EIBDMO Cc1cccc(C[NH2+]Cc2csc([N+](=O)[O-])c2)c1Br ZINC000190320254 1032852238 /nfs/dbraw/zinc/85/22/38/1032852238.db2.gz YIAJDZCXBZDUBD-UHFFFAOYSA-N 1 1 341.230 4.017 20 5 EIBDMO CC[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000120729737 1020104454 /nfs/dbraw/zinc/10/44/54/1020104454.db2.gz BMAZQIHIYWDVKD-CZUORRHYSA-N 1 1 344.415 4.045 20 5 EIBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccc(Cl)cc1 ZINC000083128017 1020201489 /nfs/dbraw/zinc/20/14/89/1020201489.db2.gz AZBIJIYEAOGULZ-UHFFFAOYSA-N 1 1 331.759 4.021 20 5 EIBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccc(Cl)cc1 ZINC000083128017 1020201495 /nfs/dbraw/zinc/20/14/95/1020201495.db2.gz AZBIJIYEAOGULZ-UHFFFAOYSA-N 1 1 331.759 4.021 20 5 EIBDMO C[N@H+]1CC[C@H](Nc2cnc3c4ccccc4c4ccccc4c3n2)C1 ZINC001167270260 1020743787 /nfs/dbraw/zinc/74/37/87/1020743787.db2.gz QMQYFMXQONWUGC-AWEZNQCLSA-N 1 1 328.419 4.052 20 5 EIBDMO C[N@@H+](CCc1ccc(Cl)cc1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000177074616 1020951331 /nfs/dbraw/zinc/95/13/31/1020951331.db2.gz LONLVZZRYCHZJZ-UHFFFAOYSA-N 1 1 345.786 4.064 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCN(c2cccc(Cl)c2)CC1 ZINC000023699629 1021155854 /nfs/dbraw/zinc/15/58/54/1021155854.db2.gz ONSQLNSIQGLQHG-CQSZACIVSA-N 1 1 345.830 4.131 20 5 EIBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCCC3(CCCCC3)C2)cc1 ZINC001167342411 1021327730 /nfs/dbraw/zinc/32/77/30/1021327730.db2.gz WVBFVXFCNNQJMC-UHFFFAOYSA-N 1 1 332.444 4.410 20 5 EIBDMO C[C@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1nccn1-c1ccccc1 ZINC000582370694 1021935141 /nfs/dbraw/zinc/93/51/41/1021935141.db2.gz XKRIJRGNEWWYMX-KSSFIOAISA-N 1 1 348.406 4.119 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cccc(C(F)(F)F)n1 ZINC000582587994 1022098304 /nfs/dbraw/zinc/09/83/04/1022098304.db2.gz SWXVCGHCPAQDLU-NSHDSACASA-N 1 1 339.317 4.168 20 5 EIBDMO O=[N+]([O-])c1cccc([C@@H]([NH2+]Cc2cccc(O)c2)c2ccccc2)c1 ZINC000180389298 1022601895 /nfs/dbraw/zinc/60/18/95/1022601895.db2.gz PWVNVMSNRILXHA-FQEVSTJZSA-N 1 1 334.375 4.180 20 5 EIBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1CCC[C@H]2CCC[C@H]21 ZINC001167437077 1022637388 /nfs/dbraw/zinc/63/73/88/1022637388.db2.gz BZJSFYLLCIABAC-BXUZGUMPSA-N 1 1 339.233 4.122 20 5 EIBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CCC[C@H]2CCC[C@H]21 ZINC001167437077 1022637406 /nfs/dbraw/zinc/63/74/06/1022637406.db2.gz BZJSFYLLCIABAC-BXUZGUMPSA-N 1 1 339.233 4.122 20 5 EIBDMO COc1ccc(F)cc1C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000189211020 1023041457 /nfs/dbraw/zinc/04/14/57/1023041457.db2.gz RHNKFZKHVHWFBC-UHFFFAOYSA-N 1 1 332.375 4.156 20 5 EIBDMO CCCc1nc(C)c(C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)o1 ZINC000417325326 1023266717 /nfs/dbraw/zinc/26/67/17/1023266717.db2.gz BVSACFYMAIJNNT-KRWDZBQOSA-N 1 1 343.427 4.401 20 5 EIBDMO CC[C@H](NC[C@@H]1CCC[N@H+](CC(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000537950557 1023307655 /nfs/dbraw/zinc/30/76/55/1023307655.db2.gz CIDFOVIMDUABCP-LPHOPBHVSA-N 1 1 333.476 4.004 20 5 EIBDMO CC[C@H](NC[C@@H]1CCC[N@@H+](CC(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000537950557 1023307661 /nfs/dbraw/zinc/30/76/61/1023307661.db2.gz CIDFOVIMDUABCP-LPHOPBHVSA-N 1 1 333.476 4.004 20 5 EIBDMO C[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1nccn1-c1ccccc1 ZINC000376802737 1023313745 /nfs/dbraw/zinc/31/37/45/1023313745.db2.gz SJEOVEBAPWUILS-HUUCEWRRSA-N 1 1 336.395 4.192 20 5 EIBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000051132321 1023469868 /nfs/dbraw/zinc/46/98/68/1023469868.db2.gz XZLPSWRFGQBTNM-AZUAARDMSA-N 1 1 340.423 4.195 20 5 EIBDMO COc1ccc([C@H](C)[N@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000541128296 1023502989 /nfs/dbraw/zinc/50/29/89/1023502989.db2.gz XSSYWHGLFLXOMG-LBPRGKRZSA-N 1 1 334.803 4.450 20 5 EIBDMO COc1ccc([C@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000541128296 1023502996 /nfs/dbraw/zinc/50/29/96/1023502996.db2.gz XSSYWHGLFLXOMG-LBPRGKRZSA-N 1 1 334.803 4.450 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H](c4cccnc4)C3)o2)cc1 ZINC000581944282 1023921094 /nfs/dbraw/zinc/92/10/94/1023921094.db2.gz AWNGSOBTYTWUMN-KRWDZBQOSA-N 1 1 349.390 4.239 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@H]4CCC[C@H]43)cs2)c1 ZINC000511844090 1023931531 /nfs/dbraw/zinc/93/15/31/1023931531.db2.gz PLBDGVYXIGDJRZ-CXAGYDPISA-N 1 1 343.452 4.483 20 5 EIBDMO C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccc(Br)cc1 ZINC000049515630 1024826391 /nfs/dbraw/zinc/82/63/91/1024826391.db2.gz BABIQLOQJJPTBQ-VIFPVBQESA-N 1 1 341.230 4.270 20 5 EIBDMO COc1ccc(C)cc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000535725918 1024896076 /nfs/dbraw/zinc/89/60/76/1024896076.db2.gz JMHDURDLVSGXQV-UHFFFAOYSA-N 1 1 326.396 4.076 20 5 EIBDMO COc1ccc(C)cc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000535725918 1024896079 /nfs/dbraw/zinc/89/60/79/1024896079.db2.gz JMHDURDLVSGXQV-UHFFFAOYSA-N 1 1 326.396 4.076 20 5 EIBDMO COc1ccc(C[N@H+](Cc2ccccc2)CC2CCC2)cc1[N+](=O)[O-] ZINC000065161776 1025060850 /nfs/dbraw/zinc/06/08/50/1025060850.db2.gz PWFITXNFUNUKKX-UHFFFAOYSA-N 1 1 340.423 4.406 20 5 EIBDMO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000611561492 1025386059 /nfs/dbraw/zinc/38/60/59/1025386059.db2.gz RMIUHHFUJDGHHO-HRLNJXSSSA-N 1 1 328.334 4.271 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C2CC2)cc1 ZINC000506742495 1025552134 /nfs/dbraw/zinc/55/21/34/1025552134.db2.gz GTJOHOYULVCTTH-UHFFFAOYSA-N 1 1 326.396 4.076 20 5 EIBDMO COc1ccc([C@@H](C)[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])cc1F ZINC000182004156 1025777156 /nfs/dbraw/zinc/77/71/56/1025777156.db2.gz PNSZSRZHRRISDL-SNVBAGLBSA-N 1 1 338.766 4.247 20 5 EIBDMO CC(C)[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccc(F)cc1 ZINC000506815831 1025804434 /nfs/dbraw/zinc/80/44/34/1025804434.db2.gz NPOYBLVVDUCVMW-UHFFFAOYSA-N 1 1 342.374 4.021 20 5 EIBDMO CC(C)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccc(F)cc1 ZINC000506815831 1025804437 /nfs/dbraw/zinc/80/44/37/1025804437.db2.gz NPOYBLVVDUCVMW-UHFFFAOYSA-N 1 1 342.374 4.021 20 5 EIBDMO COc1cc(C[NH2+][C@@H](C)c2ccccc2Cl)c([N+](=O)[O-])cc1F ZINC000184239316 1026249244 /nfs/dbraw/zinc/24/92/44/1026249244.db2.gz KKPPURTUWBVHAL-JTQLQIEISA-N 1 1 338.766 4.247 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[NH2+]C1(c2ccc(Br)cc2)CC1 ZINC000120028663 1026390350 /nfs/dbraw/zinc/39/03/50/1026390350.db2.gz UETDHAYAUVCZBL-UHFFFAOYSA-N 1 1 347.212 4.136 20 5 EIBDMO CC[C@H]([NH2+][C@@H](C)c1nc2c(s1)CCC2)c1cccc([N+](=O)[O-])c1 ZINC000135062975 1026541901 /nfs/dbraw/zinc/54/19/01/1026541901.db2.gz IYAAEZJSCIDAFE-FZMZJTMJSA-N 1 1 331.441 4.342 20 5 EIBDMO Cc1cc(N[C@@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000507001911 1026573469 /nfs/dbraw/zinc/57/34/69/1026573469.db2.gz MCRDMYKZWBJURT-CRAIPNDOSA-N 1 1 325.412 4.151 20 5 EIBDMO Cc1cc(N[C@@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000507001912 1026573994 /nfs/dbraw/zinc/57/39/94/1026573994.db2.gz MCRDMYKZWBJURT-MAUKXSAKSA-N 1 1 325.412 4.151 20 5 EIBDMO CC(C)C[C@@H]1CCC[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000507134795 1026663992 /nfs/dbraw/zinc/66/39/92/1026663992.db2.gz OKECXUXXUNLRLR-SFHVURJKSA-N 1 1 342.443 4.006 20 5 EIBDMO C[N@H+](Cc1cccc(-c2ccccn2)c1)Cc1ccccc1[N+](=O)[O-] ZINC000507168740 1026682332 /nfs/dbraw/zinc/68/23/32/1026682332.db2.gz FWQFODYJAGYFAZ-UHFFFAOYSA-N 1 1 333.391 4.289 20 5 EIBDMO C[N@@H+](Cc1cccc(-c2ccccn2)c1)Cc1ccccc1[N+](=O)[O-] ZINC000507168740 1026682334 /nfs/dbraw/zinc/68/23/34/1026682334.db2.gz FWQFODYJAGYFAZ-UHFFFAOYSA-N 1 1 333.391 4.289 20 5 EIBDMO C[C@H](Nc1ccc([N+](=O)[O-])cc1F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310795436 1027404531 /nfs/dbraw/zinc/40/45/31/1027404531.db2.gz FMJFBTAOYQTWLC-GOEBONIOSA-N 1 1 343.402 4.056 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000441401219 1027525066 /nfs/dbraw/zinc/52/50/66/1027525066.db2.gz XUZQZULIUKAJAR-SQNIBIBYSA-N 1 1 345.487 4.242 20 5 EIBDMO COC(=O)c1cc([C@H](C)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)oc1C ZINC000292389249 1027677278 /nfs/dbraw/zinc/67/72/78/1027677278.db2.gz HZLDWKQKZQIZAR-NEPJUHHUSA-N 1 1 346.383 4.003 20 5 EIBDMO C[C@H]1CCCC[C@H]1[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000444661629 1027933366 /nfs/dbraw/zinc/93/33/66/1027933366.db2.gz IDZKVAFETDMAGP-SUMWQHHRSA-N 1 1 329.400 4.260 20 5 EIBDMO CCc1ccc([C@H](COC)[NH2+][C@H](CC)c2cccc([N+](=O)[O-])c2)o1 ZINC000165287043 1028078948 /nfs/dbraw/zinc/07/89/48/1028078948.db2.gz GNCWBTJEUCJFDU-SJORKVTESA-N 1 1 332.400 4.179 20 5 EIBDMO CC[C@@H]1CCCCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000536372447 1028197861 /nfs/dbraw/zinc/19/78/61/1028197861.db2.gz XTXYGUWRFUEKCJ-MRXNPFEDSA-N 1 1 329.400 4.404 20 5 EIBDMO COc1ccc([N+](=O)[O-])c(NCc2ccccc2C[N@@H+](C)C(C)C)c1 ZINC000524690068 1029170846 /nfs/dbraw/zinc/17/08/46/1029170846.db2.gz PARPYOMIYUUFQH-UHFFFAOYSA-N 1 1 343.427 4.056 20 5 EIBDMO COc1ccc(C[N@@H+]2CCCCC[C@@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000523009218 1029397585 /nfs/dbraw/zinc/39/75/85/1029397585.db2.gz SHJBIDZPZAKALU-OAHLLOKOSA-N 1 1 330.384 4.314 20 5 EIBDMO COc1ccc(C[N@H+]2CCCCC[C@@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000523009218 1029397602 /nfs/dbraw/zinc/39/76/02/1029397602.db2.gz SHJBIDZPZAKALU-OAHLLOKOSA-N 1 1 330.384 4.314 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCN(c2cccc(Cl)c2)CC1 ZINC000441164538 1029653478 /nfs/dbraw/zinc/65/34/78/1029653478.db2.gz GJFKEHQWPYYDDP-CQSZACIVSA-N 1 1 345.830 4.131 20 5 EIBDMO CC1CCC([N@H+](Cc2ccccc2[N+](=O)[O-])C[C@H]2CCCO2)CC1 ZINC000441456053 1030186811 /nfs/dbraw/zinc/18/68/11/1030186811.db2.gz FPBPDHZWXAXLJI-VMWRSERWSA-N 1 1 332.444 4.155 20 5 EIBDMO CCOc1cc(C[N@@H+]2CC[C@H](C(F)(F)F)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000451410579 1030471303 /nfs/dbraw/zinc/47/13/03/1030471303.db2.gz SRRAVWQIALQGJQ-YPMHNXCESA-N 1 1 346.349 4.156 20 5 EIBDMO CCOc1cc(C[N@H+]2CC[C@H](C(F)(F)F)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000451410579 1030471318 /nfs/dbraw/zinc/47/13/18/1030471318.db2.gz SRRAVWQIALQGJQ-YPMHNXCESA-N 1 1 346.349 4.156 20 5 EIBDMO Cc1nc(C(C)C)oc1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451553107 1030571254 /nfs/dbraw/zinc/57/12/54/1030571254.db2.gz XHLPCJCHFMVATJ-MRXNPFEDSA-N 1 1 343.427 4.394 20 5 EIBDMO C[C@H]1Cc2cc(F)ccc2[C@H](C)[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001168234564 1031387595 /nfs/dbraw/zinc/38/75/95/1031387595.db2.gz MKRSJDUYFRWZKI-KBPBESRZSA-N 1 1 344.386 4.121 20 5 EIBDMO Cc1ccc(C2=CC[N@H+](Cc3c(F)cccc3[N+](=O)[O-])CC2)cc1 ZINC000728911635 1031894767 /nfs/dbraw/zinc/89/47/67/1031894767.db2.gz HDEIZLYFEMNOKF-UHFFFAOYSA-N 1 1 326.371 4.332 20 5 EIBDMO Cc1ccc(C2=CC[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])CC2)cc1 ZINC000728911635 1031894798 /nfs/dbraw/zinc/89/47/98/1031894798.db2.gz HDEIZLYFEMNOKF-UHFFFAOYSA-N 1 1 326.371 4.332 20 5 EIBDMO Cc1cc(NC[C@H]2CC[N@H+](C(C)C)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000573653711 1033421817 /nfs/dbraw/zinc/42/18/17/1033421817.db2.gz UBCQENULPDKFSG-GFCCVEGCSA-N 1 1 345.365 4.064 20 5 EIBDMO CC1(C)C[C@H](NC2CC(C)(C)[NH2+]C(C)(C)C2)c2cc([N+](=O)[O-])ccc21 ZINC000433145188 1033938911 /nfs/dbraw/zinc/93/89/11/1033938911.db2.gz PKXDXKVRHKAPPI-KRWDZBQOSA-N 1 1 345.487 4.216 20 5 EIBDMO CC[NH+](CC)Cc1ccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000120507118 1034058999 /nfs/dbraw/zinc/05/89/99/1034058999.db2.gz PZTNKYNTMJTJEC-MRXNPFEDSA-N 1 1 341.455 4.287 20 5 EIBDMO O=[N+]([O-])c1ccc(NC[C@H](c2ccco2)[NH+]2CCCCC2)c(Cl)c1 ZINC000015170581 1034640537 /nfs/dbraw/zinc/64/05/37/1034640537.db2.gz RIACUPGDYPYTIA-MRXNPFEDSA-N 1 1 349.818 4.480 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H]1CSc2ccccc21 ZINC000595009903 1035504370 /nfs/dbraw/zinc/50/43/70/1035504370.db2.gz UJFUXUGFVJEIQM-ABAIWWIYSA-N 1 1 330.409 4.101 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000595018509 1035508289 /nfs/dbraw/zinc/50/82/89/1035508289.db2.gz QPVGREWMCAMYGB-WQGACYEGSA-N 1 1 330.384 4.171 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000595018508 1035508759 /nfs/dbraw/zinc/50/87/59/1035508759.db2.gz QPVGREWMCAMYGB-MQIPJXDCSA-N 1 1 330.384 4.171 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C1(c2ccccc2F)CCC1 ZINC000595045714 1035567149 /nfs/dbraw/zinc/56/71/49/1035567149.db2.gz OCJNLEMUNCBTLX-CYBMUJFWSA-N 1 1 344.386 4.473 20 5 EIBDMO Cc1noc(C[N@H+]2CCC[C@H]2c2ccc(C(C)C)cc2)c1[N+](=O)[O-] ZINC000595395739 1035667781 /nfs/dbraw/zinc/66/77/81/1035667781.db2.gz NQUIRFDLYGCJQQ-INIZCTEOSA-N 1 1 329.400 4.352 20 5 EIBDMO Cc1noc(C[N@@H+]2CCC[C@H]2c2ccc(C(C)C)cc2)c1[N+](=O)[O-] ZINC000595395739 1035667792 /nfs/dbraw/zinc/66/77/92/1035667792.db2.gz NQUIRFDLYGCJQQ-INIZCTEOSA-N 1 1 329.400 4.352 20 5 EIBDMO CCC(CC)([NH2+]Cc1onc(C)c1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000595371152 1035669923 /nfs/dbraw/zinc/66/99/23/1035669923.db2.gz RXQKGAROHVMERH-UHFFFAOYSA-N 1 1 337.807 4.350 20 5 EIBDMO Cc1noc(C[N@H+]([C@@H](C)c2ccccc2)C2CCCC2)c1[N+](=O)[O-] ZINC000595483696 1035679033 /nfs/dbraw/zinc/67/90/33/1035679033.db2.gz UUNWQSBMMCJXQU-AWEZNQCLSA-N 1 1 329.400 4.397 20 5 EIBDMO Cc1noc(C[N@H+]2C[C@H](c3ccccc3)[C@@H]3CCCC[C@@H]32)c1[N+](=O)[O-] ZINC000595450211 1035683074 /nfs/dbraw/zinc/68/30/74/1035683074.db2.gz SFKNCUZVQMTHAE-BBWFWOEESA-N 1 1 341.411 4.049 20 5 EIBDMO CC(C)(C)[N@H+](Cc1ccsc1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000595600837 1035743747 /nfs/dbraw/zinc/74/37/47/1035743747.db2.gz KKSMKNPKTSNPQG-UHFFFAOYSA-N 1 1 344.440 4.333 20 5 EIBDMO CC(C)(C)[N@@H+](Cc1ccsc1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000595600837 1035743765 /nfs/dbraw/zinc/74/37/65/1035743765.db2.gz KKSMKNPKTSNPQG-UHFFFAOYSA-N 1 1 344.440 4.333 20 5 EIBDMO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000491181088 1035815883 /nfs/dbraw/zinc/81/58/83/1035815883.db2.gz CAJOONUNPQNDOH-KRWDZBQOSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000491181088 1035815890 /nfs/dbraw/zinc/81/58/90/1035815890.db2.gz CAJOONUNPQNDOH-KRWDZBQOSA-N 1 1 330.359 4.080 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC(C)(C)[C@@H]1c1ccncc1 ZINC000596591211 1035908736 /nfs/dbraw/zinc/90/87/36/1035908736.db2.gz IDPWEQCTWLZRHD-KSSFIOAISA-N 1 1 325.412 4.442 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC(C)(C)[C@@H]1c1ccncc1 ZINC000596591211 1035908777 /nfs/dbraw/zinc/90/87/77/1035908777.db2.gz IDPWEQCTWLZRHD-KSSFIOAISA-N 1 1 325.412 4.442 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC(C)(C)[C@@H]1c1ccncc1 ZINC000596591210 1035910997 /nfs/dbraw/zinc/91/09/97/1035910997.db2.gz IDPWEQCTWLZRHD-KDOFPFPSSA-N 1 1 325.412 4.442 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC(C)(C)[C@@H]1c1ccncc1 ZINC000596591210 1035911027 /nfs/dbraw/zinc/91/10/27/1035911027.db2.gz IDPWEQCTWLZRHD-KDOFPFPSSA-N 1 1 325.412 4.442 20 5 EIBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)CC1=CCSC1 ZINC000597246505 1036176229 /nfs/dbraw/zinc/17/62/29/1036176229.db2.gz VGVWRHPGNKBPMB-UHFFFAOYSA-N 1 1 346.477 4.428 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@@H](C)c1ccc(F)cc1 ZINC000485801629 1036284482 /nfs/dbraw/zinc/28/44/82/1036284482.db2.gz PULRKURPAUNXDM-ZDUSSCGKSA-N 1 1 332.375 4.326 20 5 EIBDMO CC[C@@H]1C[C@@]1([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1cccc(C)c1 ZINC000502564760 1036358158 /nfs/dbraw/zinc/35/81/58/1036358158.db2.gz ILMPNHKVLIXCGC-KUHUBIRLSA-N 1 1 328.387 4.457 20 5 EIBDMO CC[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C[C@H](O)c1ccc(C)cc1 ZINC000761254303 1036457689 /nfs/dbraw/zinc/45/76/89/1036457689.db2.gz UIWFOQOKKYLXLC-SFHVURJKSA-N 1 1 348.830 4.112 20 5 EIBDMO CC[C@](C)([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccc(F)cc1 ZINC000602729572 1036595062 /nfs/dbraw/zinc/59/50/62/1036595062.db2.gz WILULUHDVXFJMC-SFHVURJKSA-N 1 1 343.358 4.290 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2ccccc2CC(F)(F)F)cs1 ZINC000599018360 1036852952 /nfs/dbraw/zinc/85/29/52/1036852952.db2.gz WKGYZIQGYFLDDN-UHFFFAOYSA-N 1 1 330.331 4.051 20 5 EIBDMO CC1(C)C[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])c2cc(F)ccc2O1 ZINC000593674390 1036874609 /nfs/dbraw/zinc/87/46/09/1036874609.db2.gz RNDGNMLBINTKBB-OAHLLOKOSA-N 1 1 330.359 4.126 20 5 EIBDMO Cc1c(C[NH2+]Cc2cccc(Cl)c2Cl)cccc1[N+](=O)[O-] ZINC000231883925 1037007259 /nfs/dbraw/zinc/00/72/59/1037007259.db2.gz PFRZKUITCSQYBY-UHFFFAOYSA-N 1 1 325.195 4.500 20 5 EIBDMO CC[N@H+](Cc1ccc(Cl)s1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000603837457 1037031835 /nfs/dbraw/zinc/03/18/35/1037031835.db2.gz VJQFXEHGJTUGGG-UHFFFAOYSA-N 1 1 340.832 4.340 20 5 EIBDMO CC[N@@H+](Cc1ccc(Cl)s1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000603837457 1037031847 /nfs/dbraw/zinc/03/18/47/1037031847.db2.gz VJQFXEHGJTUGGG-UHFFFAOYSA-N 1 1 340.832 4.340 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2ccc(Cl)o2)cc(C(F)(F)F)c1 ZINC000487199071 1037046552 /nfs/dbraw/zinc/04/65/52/1037046552.db2.gz LUYUGNFZMMUSDM-UHFFFAOYSA-N 1 1 334.681 4.150 20 5 EIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@@H]1c1cccc(Cl)c1 ZINC000603854139 1037047965 /nfs/dbraw/zinc/04/79/65/1037047965.db2.gz SDOYCOONNBOTPY-MRXNPFEDSA-N 1 1 346.814 4.464 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@@H]2CCc2ccccc2)cc1[N+](=O)[O-] ZINC000603855854 1037050294 /nfs/dbraw/zinc/05/02/94/1037050294.db2.gz ZDPNPKQWNKXECW-GOSISDBHSA-N 1 1 340.423 4.201 20 5 EIBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+](Cc1ccco1)C1CCCC1 ZINC000603855190 1037050640 /nfs/dbraw/zinc/05/06/40/1037050640.db2.gz DYTGLXUXRVDVJT-UHFFFAOYSA-N 1 1 330.384 4.011 20 5 EIBDMO CC(C)[N@H+](Cc1nc2cc(F)ccc2o1)Cc1ccc([N+](=O)[O-])cc1 ZINC000133664809 1037136251 /nfs/dbraw/zinc/13/62/51/1037136251.db2.gz LWGGXDXTXLADIT-UHFFFAOYSA-N 1 1 343.358 4.286 20 5 EIBDMO CC(C)[N@@H+](Cc1nc2cc(F)ccc2o1)Cc1ccc([N+](=O)[O-])cc1 ZINC000133664809 1037136260 /nfs/dbraw/zinc/13/62/60/1037136260.db2.gz LWGGXDXTXLADIT-UHFFFAOYSA-N 1 1 343.358 4.286 20 5 EIBDMO Cc1ccc(C[NH2+]Cc2cccc(Cl)c2Cl)cc1[N+](=O)[O-] ZINC000604532730 1037428561 /nfs/dbraw/zinc/42/85/61/1037428561.db2.gz YUAJIVMVAMCXHP-UHFFFAOYSA-N 1 1 325.195 4.500 20 5 EIBDMO COc1cc(C[NH2+]C2(c3cccc(F)c3)CCC2)c([N+](=O)[O-])cc1F ZINC000592144330 1037749254 /nfs/dbraw/zinc/74/92/54/1037749254.db2.gz FBJAMHZMYFLMLC-UHFFFAOYSA-N 1 1 348.349 4.051 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)C[C@@H]1OCCc2ccccc21 ZINC000489150034 1037882848 /nfs/dbraw/zinc/88/28/48/1037882848.db2.gz AJPDUKOAJQBGSI-QRWLVFNGSA-N 1 1 340.423 4.210 20 5 EIBDMO CC(C)c1ccc([C@@H](N)C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000423235118 1038052784 /nfs/dbraw/zinc/05/27/84/1038052784.db2.gz GHUVHXIREOMJKX-KUHUBIRLSA-N 1 1 327.428 4.069 20 5 EIBDMO CC(C)c1ccc([C@@H](N)C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000423243138 1038076286 /nfs/dbraw/zinc/07/62/86/1038076286.db2.gz MTRKAWPNUDPSRU-KUHUBIRLSA-N 1 1 327.428 4.069 20 5 EIBDMO C[C@@H](N[C@@H]1CC[NH2+][C@H](C)C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423381309 1038195514 /nfs/dbraw/zinc/19/55/14/1038195514.db2.gz OJHASBMKGWFRQU-MGPQQGTHSA-N 1 1 345.468 4.114 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC000490017012 1038317451 /nfs/dbraw/zinc/31/74/51/1038317451.db2.gz XESOBGCVZMUMIK-YJBOKZPZSA-N 1 1 325.412 4.232 20 5 EIBDMO Cc1c(NC(=O)CC[N@@H+](C2CC2)C2CCCCC2)cccc1[N+](=O)[O-] ZINC000063497950 1038394396 /nfs/dbraw/zinc/39/43/96/1038394396.db2.gz ZUPFHTLYHMBBIN-UHFFFAOYSA-N 1 1 345.443 4.029 20 5 EIBDMO CC[C@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1cccc([N+](=O)[O-])c1 ZINC000539063005 1038807802 /nfs/dbraw/zinc/80/78/02/1038807802.db2.gz NPKIJPKWRPEXQK-JKSUJKDBSA-N 1 1 332.787 4.423 20 5 EIBDMO C[C@@H]1CCC[C@H](C)[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000534121139 1039120094 /nfs/dbraw/zinc/12/00/94/1039120094.db2.gz JXACGSOSAOVDPI-KGLIPLIRSA-N 1 1 329.400 4.260 20 5 EIBDMO COc1ccccc1[C@@H]1CCCC[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000730062360 1039164849 /nfs/dbraw/zinc/16/48/49/1039164849.db2.gz MBGARROFNNCWKW-SFHVURJKSA-N 1 1 344.386 4.470 20 5 EIBDMO COc1ccccc1[C@@H]1CCCC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000730062360 1039164866 /nfs/dbraw/zinc/16/48/66/1039164866.db2.gz MBGARROFNNCWKW-SFHVURJKSA-N 1 1 344.386 4.470 20 5 EIBDMO C[N@H+]1CC[C@H](Nc2ccc3ncccc3c2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000534270576 1039283501 /nfs/dbraw/zinc/28/35/01/1039283501.db2.gz BFTGSCCJZZWCRJ-OALUTQOASA-N 1 1 348.406 4.000 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000481691674 1039734525 /nfs/dbraw/zinc/73/45/25/1039734525.db2.gz HZAUUISFFIEQRE-MGPUTAFESA-N 1 1 338.407 4.177 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000481691676 1039735899 /nfs/dbraw/zinc/73/58/99/1039735899.db2.gz HZAUUISFFIEQRE-QRWLVFNGSA-N 1 1 338.407 4.177 20 5 EIBDMO CCc1ccc([C@H](COC)[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)o1 ZINC000192899613 1039846664 /nfs/dbraw/zinc/84/66/64/1039846664.db2.gz ZOCZUQKNDJGBNZ-ROUUACIJSA-N 1 1 344.411 4.105 20 5 EIBDMO COc1cccc(F)c1[C@@H](C)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192904856 1039851573 /nfs/dbraw/zinc/85/15/73/1039851573.db2.gz SSZUYSZYVGJURR-PXAZEXFGSA-N 1 1 344.386 4.471 20 5 EIBDMO CC[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C1CCCCC1 ZINC000535526966 1040328725 /nfs/dbraw/zinc/32/87/25/1040328725.db2.gz YFUZSLLQOKRZNZ-UHFFFAOYSA-N 1 1 329.400 4.404 20 5 EIBDMO CC(C)(C)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccccc1 ZINC000482697727 1040436176 /nfs/dbraw/zinc/43/61/76/1040436176.db2.gz WFOMUSWDMBZWHX-UHFFFAOYSA-N 1 1 338.411 4.272 20 5 EIBDMO CCOc1ccc([C@H](C)Nc2ccc3c(c2)[nH+]cn3C)cc1[N+](=O)[O-] ZINC000539737077 1040738670 /nfs/dbraw/zinc/73/86/70/1040738670.db2.gz KQYYZVZWUUJENP-LBPRGKRZSA-N 1 1 340.383 4.053 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+][C@H]2COc3ccc(Cl)cc32)cc1[N+](=O)[O-] ZINC000537956261 1040925578 /nfs/dbraw/zinc/92/55/78/1040925578.db2.gz IYFCMSVXEFRRAX-NHYWBVRUSA-N 1 1 332.787 4.341 20 5 EIBDMO Cc1c([C@@H](C)NCCC[N@@H+](C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000480159296 1041015632 /nfs/dbraw/zinc/01/56/32/1041015632.db2.gz LHMYLERCCRGCSV-QGZVFWFLSA-N 1 1 341.455 4.076 20 5 EIBDMO Cc1c([C@@H](C)[NH2+]CCCN(C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000480159296 1041015668 /nfs/dbraw/zinc/01/56/68/1041015668.db2.gz LHMYLERCCRGCSV-QGZVFWFLSA-N 1 1 341.455 4.076 20 5 EIBDMO CC(C)[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@H]1CCOC1 ZINC000462878066 1041060364 /nfs/dbraw/zinc/06/03/64/1041060364.db2.gz QIDSZRYPWWSXTO-INIZCTEOSA-N 1 1 346.452 4.323 20 5 EIBDMO COCCCCc1ccc[nH+]c1NCc1ccc([N+](=O)[O-])cc1Cl ZINC000461228587 1041300033 /nfs/dbraw/zinc/30/00/33/1041300033.db2.gz WOUCKUUIHQDVBV-UHFFFAOYSA-N 1 1 349.818 4.224 20 5 EIBDMO COc1ccccc1C[N@@H+](C)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000470171269 1041440796 /nfs/dbraw/zinc/44/07/96/1041440796.db2.gz HMRFZGSSMACSRZ-PTNGSMBKSA-N 1 1 326.396 4.139 20 5 EIBDMO COC(C)(C)C[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000538828336 1041554409 /nfs/dbraw/zinc/55/44/09/1041554409.db2.gz YJBYQFNWMJLGOA-UHFFFAOYSA-N 1 1 334.441 4.180 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@H](c2ccccn2)C1 ZINC000595503232 1041763596 /nfs/dbraw/zinc/76/35/96/1041763596.db2.gz YVFRCHSYWVQQLH-ZDUSSCGKSA-N 1 1 331.803 4.023 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@H](c2ccccn2)C1 ZINC000595503232 1041763603 /nfs/dbraw/zinc/76/36/03/1041763603.db2.gz YVFRCHSYWVQQLH-ZDUSSCGKSA-N 1 1 331.803 4.023 20 5 EIBDMO COc1cccc2c1CC[N@@H+]([C@H](C)c1cc([N+](=O)[O-])ccc1C)C2 ZINC000541084257 1041805112 /nfs/dbraw/zinc/80/51/12/1041805112.db2.gz NDCFGKDIQIIZSB-CQSZACIVSA-N 1 1 326.396 4.031 20 5 EIBDMO COc1cccc2c1CC[N@H+]([C@H](C)c1cc([N+](=O)[O-])ccc1C)C2 ZINC000541084257 1041805114 /nfs/dbraw/zinc/80/51/14/1041805114.db2.gz NDCFGKDIQIIZSB-CQSZACIVSA-N 1 1 326.396 4.031 20 5 EIBDMO CC[N@H+](Cc1cccs1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000506051471 1041811938 /nfs/dbraw/zinc/81/19/38/1041811938.db2.gz NVCYBDYPWRJEGL-UHFFFAOYSA-N 1 1 342.367 4.280 20 5 EIBDMO CC[N@@H+](Cc1cccs1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000506051471 1041811942 /nfs/dbraw/zinc/81/19/42/1041811942.db2.gz NVCYBDYPWRJEGL-UHFFFAOYSA-N 1 1 342.367 4.280 20 5 EIBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000464769630 1042149179 /nfs/dbraw/zinc/14/91/79/1042149179.db2.gz IJWFSTUJIRNXCK-ZIAGYGMSSA-N 1 1 328.865 4.354 20 5 EIBDMO COc1ccc(C[N@@H+]2CC[C@H](C)C[C@@H]2c2ccc(C)o2)cc1[N+](=O)[O-] ZINC000464828898 1042186623 /nfs/dbraw/zinc/18/66/23/1042186623.db2.gz DTKVBISCNPKZIV-XJKSGUPXSA-N 1 1 344.411 4.478 20 5 EIBDMO COc1ccc(C[N@H+]2CC[C@H](C)C[C@@H]2c2ccc(C)o2)cc1[N+](=O)[O-] ZINC000464828898 1042186625 /nfs/dbraw/zinc/18/66/25/1042186625.db2.gz DTKVBISCNPKZIV-XJKSGUPXSA-N 1 1 344.411 4.478 20 5 EIBDMO COc1ccc(C[N@@H+]2CC[C@@H](C)C[C@H]2c2ccc(C)o2)cc1[N+](=O)[O-] ZINC000464828896 1042186809 /nfs/dbraw/zinc/18/68/09/1042186809.db2.gz DTKVBISCNPKZIV-CJNGLKHVSA-N 1 1 344.411 4.478 20 5 EIBDMO COc1ccc(C[N@H+]2CC[C@@H](C)C[C@H]2c2ccc(C)o2)cc1[N+](=O)[O-] ZINC000464828896 1042186811 /nfs/dbraw/zinc/18/68/11/1042186811.db2.gz DTKVBISCNPKZIV-CJNGLKHVSA-N 1 1 344.411 4.478 20 5 EIBDMO C[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@H](c2ccco2)C1 ZINC000464850629 1042197551 /nfs/dbraw/zinc/19/75/51/1042197551.db2.gz IMVDIPQBGWXDER-PBHICJAKSA-N 1 1 330.384 4.040 20 5 EIBDMO COc1cccc(C[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])CC(C)C)c1 ZINC000609144596 1042257304 /nfs/dbraw/zinc/25/73/04/1042257304.db2.gz GWOGEWMTOXNJKH-UHFFFAOYSA-N 1 1 346.402 4.401 20 5 EIBDMO COc1cccc(C[N@H+](Cc2c(F)cccc2[N+](=O)[O-])CC(C)C)c1 ZINC000609144596 1042257318 /nfs/dbraw/zinc/25/73/18/1042257318.db2.gz GWOGEWMTOXNJKH-UHFFFAOYSA-N 1 1 346.402 4.401 20 5 EIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](CC)[C@H](C)c1cccc(O)c1 ZINC000509581076 1042388816 /nfs/dbraw/zinc/38/88/16/1042388816.db2.gz XLGJGLPXDPRJLO-CQSZACIVSA-N 1 1 344.411 4.282 20 5 EIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](CC)[C@H](C)c1cccc(O)c1 ZINC000509581076 1042388818 /nfs/dbraw/zinc/38/88/18/1042388818.db2.gz XLGJGLPXDPRJLO-CQSZACIVSA-N 1 1 344.411 4.282 20 5 EIBDMO CC(C)[N@@H+](C)CCCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491356342 1042431355 /nfs/dbraw/zinc/43/13/55/1042431355.db2.gz LSZOCCPOIWCWPI-HXUWFJFHSA-N 1 1 341.455 4.004 20 5 EIBDMO COCCCC[N@@H+](Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1 ZINC000052798110 1042449858 /nfs/dbraw/zinc/44/98/58/1042449858.db2.gz ZUCFNVIZMLUIIH-UHFFFAOYSA-N 1 1 328.412 4.024 20 5 EIBDMO CCOc1cc(C[N@@H+]2CCc3sccc3[C@H]2C)ccc1[N+](=O)[O-] ZINC000492487668 1042675414 /nfs/dbraw/zinc/67/54/14/1042675414.db2.gz SJFGVWLZNPPZBS-GFCCVEGCSA-N 1 1 332.425 4.174 20 5 EIBDMO CCOc1cc(C[N@H+]2CCc3sccc3[C@H]2C)ccc1[N+](=O)[O-] ZINC000492487668 1042675418 /nfs/dbraw/zinc/67/54/18/1042675418.db2.gz SJFGVWLZNPPZBS-GFCCVEGCSA-N 1 1 332.425 4.174 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1N1CCCC1 ZINC000506721848 1042810009 /nfs/dbraw/zinc/81/00/09/1042810009.db2.gz JHGGQPLBDZZUMC-INIZCTEOSA-N 1 1 339.439 4.388 20 5 EIBDMO CCS[C@H]1CC[C@@H]([N@H+](C)Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493136841 1042827660 /nfs/dbraw/zinc/82/76/60/1042827660.db2.gz ZYMLCOXQPBWZCP-NEPJUHHUSA-N 1 1 328.865 4.354 20 5 EIBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493136841 1042827661 /nfs/dbraw/zinc/82/76/61/1042827661.db2.gz ZYMLCOXQPBWZCP-NEPJUHHUSA-N 1 1 328.865 4.354 20 5 EIBDMO CC[N@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)C[C@H](O)c1ccc(C)cc1 ZINC000761512778 1042873742 /nfs/dbraw/zinc/87/37/42/1042873742.db2.gz WTEAOKUQKXFRRZ-SFHVURJKSA-N 1 1 348.830 4.112 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccc(F)c(C(F)(F)F)c1 ZINC000162581378 1043086708 /nfs/dbraw/zinc/08/67/08/1043086708.db2.gz UDTLYOIWPKJQCD-UHFFFAOYSA-N 1 1 328.265 4.043 20 5 EIBDMO C/C(=C\c1ccccc1)C[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000494294127 1043409880 /nfs/dbraw/zinc/40/98/80/1043409880.db2.gz WQZPQYIBYANLNH-GXDHUFHOSA-N 1 1 337.379 4.271 20 5 EIBDMO C/C(=C/c1ccccc1)C[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000494294128 1043411295 /nfs/dbraw/zinc/41/12/95/1043411295.db2.gz WQZPQYIBYANLNH-UVTDQMKNSA-N 1 1 337.379 4.271 20 5 EIBDMO Cc1ccc(C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)s1 ZINC000609194481 1043446991 /nfs/dbraw/zinc/44/69/91/1043446991.db2.gz QZPRGDQCMWPHQR-UHFFFAOYSA-N 1 1 334.441 4.384 20 5 EIBDMO Cc1ccc(C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)s1 ZINC000609194481 1043446996 /nfs/dbraw/zinc/44/69/96/1043446996.db2.gz QZPRGDQCMWPHQR-UHFFFAOYSA-N 1 1 334.441 4.384 20 5 EIBDMO Cc1c(C[N@@H+]2CCCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@H]2O)cccc1[N+](=O)[O-] ZINC000438993670 1043741569 /nfs/dbraw/zinc/74/15/69/1043741569.db2.gz ACUJEQHOLGEVQH-GIPAHHNCSA-N 1 1 346.471 4.055 20 5 EIBDMO Cc1cc(C)cc([C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)c2cccnc2)c1 ZINC000731453226 1043762617 /nfs/dbraw/zinc/76/26/17/1043762617.db2.gz YDQLZVIJXYJKDQ-OAQYLSRUSA-N 1 1 347.418 4.486 20 5 EIBDMO C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])c3cnccc23)[C@H]1c1ccccc1 ZINC000301854521 1043818067 /nfs/dbraw/zinc/81/80/67/1043818067.db2.gz YITFKBCLZGQXKC-UYAOXDASSA-N 1 1 348.406 4.000 20 5 EIBDMO C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])c3cnccc23)[C@H]1c1ccccc1 ZINC000301854514 1043819000 /nfs/dbraw/zinc/81/90/00/1043819000.db2.gz YITFKBCLZGQXKC-AZUAARDMSA-N 1 1 348.406 4.000 20 5 EIBDMO CC(C)C[C@@H]1CC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000245493712 1043940482 /nfs/dbraw/zinc/94/04/82/1043940482.db2.gz MBISVYMQXASIIU-KGLIPLIRSA-N 1 1 344.415 4.074 20 5 EIBDMO CC(C)[C@@H](c1ccccc1)[N@@H+](C)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000732979013 1044056599 /nfs/dbraw/zinc/05/65/99/1044056599.db2.gz BNDWFXQXTJRTQY-IBGZPJMESA-N 1 1 338.411 4.231 20 5 EIBDMO COc1ccccc1C(C)(C)[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116277276 1044155397 /nfs/dbraw/zinc/15/53/97/1044155397.db2.gz IHDLOHJJXVDVNK-UHFFFAOYSA-N 1 1 334.803 4.282 20 5 EIBDMO C[C@H](c1ccc2ccccc2c1)[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000543480453 1044691165 /nfs/dbraw/zinc/69/11/65/1044691165.db2.gz MRBGMMGBLOJGIU-CQSZACIVSA-N 1 1 333.391 4.262 20 5 EIBDMO C[C@H](c1ccc2ccccc2c1)[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000543480453 1044691172 /nfs/dbraw/zinc/69/11/72/1044691172.db2.gz MRBGMMGBLOJGIU-CQSZACIVSA-N 1 1 333.391 4.262 20 5 EIBDMO CC(=O)N1CC[C@@H](C[N@H+](C)Cc2c3ccccc3cc3ccccc32)C1 ZINC000092101059 1044727617 /nfs/dbraw/zinc/72/76/17/1044727617.db2.gz MUUNUDXNZYBGEE-SFHVURJKSA-N 1 1 346.474 4.293 20 5 EIBDMO C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C1CC1)C1CC1 ZINC000092703958 1044789691 /nfs/dbraw/zinc/78/96/91/1044789691.db2.gz OMTNIZYIGSOEOA-UHFFFAOYSA-N 1 1 343.452 4.339 20 5 EIBDMO CC[C@H]1C[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCS1 ZINC000093501951 1044839604 /nfs/dbraw/zinc/83/96/04/1044839604.db2.gz FGANMHDZBXFPBU-HNNXBMFYSA-N 1 1 349.481 4.046 20 5 EIBDMO CC[C@H]1C[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCS1 ZINC000093501951 1044839605 /nfs/dbraw/zinc/83/96/05/1044839605.db2.gz FGANMHDZBXFPBU-HNNXBMFYSA-N 1 1 349.481 4.046 20 5 EIBDMO C[C@@H]1SCC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H]1C ZINC000093499629 1044840325 /nfs/dbraw/zinc/84/03/25/1044840325.db2.gz VAGYNJWDYAGNKU-RYUDHWBXSA-N 1 1 349.481 4.044 20 5 EIBDMO C[C@@H]1SCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H]1C ZINC000093499629 1044840327 /nfs/dbraw/zinc/84/03/27/1044840327.db2.gz VAGYNJWDYAGNKU-RYUDHWBXSA-N 1 1 349.481 4.044 20 5 EIBDMO CCOC[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000093838968 1044857916 /nfs/dbraw/zinc/85/79/16/1044857916.db2.gz QVGYGFDFNZHDMJ-CQSZACIVSA-N 1 1 346.452 4.182 20 5 EIBDMO CN(C)c1cccc([C@H]2CCC[N@@H+]2Cc2c(F)cccc2[N+](=O)[O-])c1 ZINC000735873324 1044871991 /nfs/dbraw/zinc/87/19/91/1044871991.db2.gz IWULCPMGTNDILP-GOSISDBHSA-N 1 1 343.402 4.137 20 5 EIBDMO CN(C)c1cccc([C@H]2CCC[N@H+]2Cc2c(F)cccc2[N+](=O)[O-])c1 ZINC000735873324 1044871993 /nfs/dbraw/zinc/87/19/93/1044871993.db2.gz IWULCPMGTNDILP-GOSISDBHSA-N 1 1 343.402 4.137 20 5 EIBDMO COc1ccc(C[NH2+]Cc2c(Cl)oc3ccccc32)cc1[N+](=O)[O-] ZINC000611182975 1045259573 /nfs/dbraw/zinc/25/95/73/1045259573.db2.gz OISVLPQZDDMKHF-UHFFFAOYSA-N 1 1 346.770 4.293 20 5 EIBDMO CC[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@@H]1CCOC1 ZINC000611256749 1045268003 /nfs/dbraw/zinc/26/80/03/1045268003.db2.gz WHADQWQJTNNKIH-AWEZNQCLSA-N 1 1 346.452 4.182 20 5 EIBDMO CC(C)OCCC[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000611272457 1045271060 /nfs/dbraw/zinc/27/10/60/1045271060.db2.gz SILVVQQFJYWGOZ-UHFFFAOYSA-N 1 1 332.400 4.102 20 5 EIBDMO COc1ccc(C[C@@H](C)[N@@H+](Cc2ccccc2)C2CC2)c([N+](=O)[O-])c1 ZINC001170353393 1046010489 /nfs/dbraw/zinc/01/04/89/1046010489.db2.gz XRAOUSIKHSFEEM-OAHLLOKOSA-N 1 1 340.423 4.199 20 5 EIBDMO CC[N@@H+](Cc1cccc(F)c1)[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170352029 1046024390 /nfs/dbraw/zinc/02/43/90/1046024390.db2.gz JWBCAQFYKNNDEF-CQSZACIVSA-N 1 1 346.402 4.196 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@]2(C)[C@@H](C1)C2(Cl)Cl ZINC000792907967 1046102621 /nfs/dbraw/zinc/10/26/21/1046102621.db2.gz QJMQQUGMBHVCOH-GLQYFDAESA-N 1 1 343.254 4.480 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC(Cc2cccnc2)CC1 ZINC000771460419 1046402160 /nfs/dbraw/zinc/40/21/60/1046402160.db2.gz LBMIBDAFSUADIK-UHFFFAOYSA-N 1 1 345.830 4.098 20 5 EIBDMO Cc1c(C[N@H+]2CCCCC[C@@H]2c2ccncc2)cccc1[N+](=O)[O-] ZINC000917054509 1046582333 /nfs/dbraw/zinc/58/23/33/1046582333.db2.gz OKTMOSWJOGUFKR-LJQANCHMSA-N 1 1 325.412 4.416 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCS[C@H]2CCCC[C@@H]21 ZINC000752361380 1046625010 /nfs/dbraw/zinc/62/50/10/1046625010.db2.gz XBVKIOVFJWGBDE-GJZGRUSLSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCS[C@H]2CCCC[C@@H]21 ZINC000752361380 1046625024 /nfs/dbraw/zinc/62/50/24/1046625024.db2.gz XBVKIOVFJWGBDE-GJZGRUSLSA-N 1 1 326.849 4.108 20 5 EIBDMO Cc1c([C@@H](C)[NH2+][C@@H]2COc3ccc(Cl)cc32)cccc1[N+](=O)[O-] ZINC000536850449 1046821739 /nfs/dbraw/zinc/82/17/39/1046821739.db2.gz GZQCPYBPWHDACH-IAQYHMDHSA-N 1 1 332.787 4.341 20 5 EIBDMO CC[C@H](C)[N@H+](Cc1ccccc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000917455133 1046895314 /nfs/dbraw/zinc/89/53/14/1046895314.db2.gz RFJXJOIJSAMFRL-HNNXBMFYSA-N 1 1 338.411 4.203 20 5 EIBDMO CCCO[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000746666796 1046974400 /nfs/dbraw/zinc/97/44/00/1046974400.db2.gz VJTPIILGSKYUQH-OAHLLOKOSA-N 1 1 326.824 4.029 20 5 EIBDMO Cc1cccc([C@H]2CCC[N@H+]2Cn2ncc3ccc([N+](=O)[O-])cc32)c1 ZINC000917617531 1047027977 /nfs/dbraw/zinc/02/79/77/1047027977.db2.gz JVZZIYXFNANIAW-GOSISDBHSA-N 1 1 336.395 4.048 20 5 EIBDMO CCOc1ccc([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000788471897 1047196171 /nfs/dbraw/zinc/19/61/71/1047196171.db2.gz WOLGAPLIYNOOOD-SFHVURJKSA-N 1 1 344.386 4.470 20 5 EIBDMO CCOc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000788471897 1047196166 /nfs/dbraw/zinc/19/61/66/1047196166.db2.gz WOLGAPLIYNOOOD-SFHVURJKSA-N 1 1 344.386 4.470 20 5 EIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCC[C@H](c2nccs2)C1 ZINC000163518585 1047595621 /nfs/dbraw/zinc/59/56/21/1047595621.db2.gz KQPOFVCOUNEPTN-NSHDSACASA-N 1 1 337.832 4.084 20 5 EIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@H](c2nccs2)C1 ZINC000163518585 1047595658 /nfs/dbraw/zinc/59/56/58/1047595658.db2.gz KQPOFVCOUNEPTN-NSHDSACASA-N 1 1 337.832 4.084 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1OC ZINC000194990777 1047895265 /nfs/dbraw/zinc/89/52/65/1047895265.db2.gz JEAMXIJDNFAUHZ-UHFFFAOYSA-N 1 1 344.411 4.023 20 5 EIBDMO CC[C@H](c1cccc(OC)c1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000808761315 1048088540 /nfs/dbraw/zinc/08/85/40/1048088540.db2.gz LQAKPTNLPTZTJH-QGZVFWFLSA-N 1 1 332.375 4.326 20 5 EIBDMO C[N@H+]1CCCC[C@H]1CNC(=O)c1c2ccccc2cc2ccccc21 ZINC001134766330 1048243100 /nfs/dbraw/zinc/24/31/00/1048243100.db2.gz YTBJRTJUAJQGLT-SFHVURJKSA-N 1 1 332.447 4.207 20 5 EIBDMO C[C@H]([NH2+][C@H](c1ccccc1)c1ccncc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815565821 1048512327 /nfs/dbraw/zinc/51/23/27/1048512327.db2.gz BEQRFFGYPOEBML-VBKZILBWSA-N 1 1 348.406 4.012 20 5 EIBDMO COC[C@@H]1CCCC[N@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000809979159 1048586429 /nfs/dbraw/zinc/58/64/29/1048586429.db2.gz OTKDIKWUKVMTDP-LLVKDONJSA-N 1 1 347.242 4.150 20 5 EIBDMO COC[C@@H]1CCCC[N@@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000809979159 1048586443 /nfs/dbraw/zinc/58/64/43/1048586443.db2.gz OTKDIKWUKVMTDP-LLVKDONJSA-N 1 1 347.242 4.150 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)s1 ZINC000846113536 1048815962 /nfs/dbraw/zinc/81/59/62/1048815962.db2.gz YLFHCJXOEZLYLO-BETUJISGSA-N 1 1 336.363 4.020 20 5 EIBDMO COc1ccc([C@H](C)[N@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000609705220 1049276353 /nfs/dbraw/zinc/27/63/53/1049276353.db2.gz HGHYMOSUOKKYHD-LBPRGKRZSA-N 1 1 334.803 4.450 20 5 EIBDMO COc1ccc([C@H](C)[N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000609705220 1049276370 /nfs/dbraw/zinc/27/63/70/1049276370.db2.gz HGHYMOSUOKKYHD-LBPRGKRZSA-N 1 1 334.803 4.450 20 5 EIBDMO Cc1ccc([C@@H]2CSCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000609706053 1049278916 /nfs/dbraw/zinc/27/89/16/1049278916.db2.gz PGZUKWQVSYIJOQ-SFHVURJKSA-N 1 1 328.437 4.193 20 5 EIBDMO Cc1ccc([C@@H]2CSCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000609706053 1049278936 /nfs/dbraw/zinc/27/89/36/1049278936.db2.gz PGZUKWQVSYIJOQ-SFHVURJKSA-N 1 1 328.437 4.193 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000609705201 1049279537 /nfs/dbraw/zinc/27/95/37/1049279537.db2.gz FMBUPOHQTOJKQL-MRXNPFEDSA-N 1 1 332.787 4.291 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000609705201 1049279552 /nfs/dbraw/zinc/27/95/52/1049279552.db2.gz FMBUPOHQTOJKQL-MRXNPFEDSA-N 1 1 332.787 4.291 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000609800898 1049331383 /nfs/dbraw/zinc/33/13/83/1049331383.db2.gz UZZSBOUPVDHUGD-QGZVFWFLSA-N 1 1 332.400 4.024 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000609800898 1049331395 /nfs/dbraw/zinc/33/13/95/1049331395.db2.gz UZZSBOUPVDHUGD-QGZVFWFLSA-N 1 1 332.400 4.024 20 5 EIBDMO COc1ccccc1[C@@H]1CC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000610004212 1049477356 /nfs/dbraw/zinc/47/73/56/1049477356.db2.gz FTCHWZFRDANJAW-GOEBONIOSA-N 1 1 326.396 4.154 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000773037442 1049543405 /nfs/dbraw/zinc/54/34/05/1049543405.db2.gz VDCMDCUQPOCZTJ-NSHDSACASA-N 1 1 349.774 4.316 20 5 EIBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1N(C)C ZINC000773036636 1049543673 /nfs/dbraw/zinc/54/36/73/1049543673.db2.gz RCNWKJHWSXANBQ-GFCCVEGCSA-N 1 1 333.819 4.165 20 5 EIBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccnc(Cl)c1 ZINC000773040115 1049547685 /nfs/dbraw/zinc/54/76/85/1049547685.db2.gz JOUPUZREHMSRHH-VIFPVBQESA-N 1 1 326.183 4.147 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CC[C@H]1CC1(Cl)Cl)C1CC1 ZINC000822771306 1049798673 /nfs/dbraw/zinc/79/86/73/1049798673.db2.gz UJWHYYZYQANIGK-LBPRGKRZSA-N 1 1 329.227 4.143 20 5 EIBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC(C)(C)CC(C)(C)C1 ZINC001171882265 1049815575 /nfs/dbraw/zinc/81/55/75/1049815575.db2.gz NFKNVOQTEICEBF-AWEZNQCLSA-N 1 1 347.459 4.070 20 5 EIBDMO C[C@H]1CC[N@@H+](Cc2c3ccccc3cc3ccccc32)CC[S@]1=O ZINC000763490234 1050062833 /nfs/dbraw/zinc/06/28/33/1050062833.db2.gz KFRMGTMUXIEJEE-UPCLLVRISA-N 1 1 337.488 4.336 20 5 EIBDMO C[C@@H]1CCC[C@H]([N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000170909070 1050105851 /nfs/dbraw/zinc/10/58/51/1050105851.db2.gz XVUNWWJJTOHDPM-ZBFHGGJFSA-N 1 1 343.427 4.303 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCC[C@@H]1c1nccs1)CC2 ZINC001172920986 1050233017 /nfs/dbraw/zinc/23/30/17/1050233017.db2.gz NFEHZQREECSRBT-NVXWUHKLSA-N 1 1 343.452 4.136 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1C[C@@H]3C[C@H](C1)c1ccccc13)CC2 ZINC001172921663 1050233898 /nfs/dbraw/zinc/23/38/98/1050233898.db2.gz QKWMUJQAVXBPKO-OTWHNJEPSA-N 1 1 348.446 4.429 20 5 EIBDMO CCC(CC)[N@@H+](CC)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173194826 1050339915 /nfs/dbraw/zinc/33/99/15/1050339915.db2.gz AMHXLIGPCLNSQT-GFCCVEGCSA-N 1 1 326.412 4.184 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC001173227221 1050356872 /nfs/dbraw/zinc/35/68/72/1050356872.db2.gz ONRWLOUFZFGPOI-GOEBONIOSA-N 1 1 328.387 4.154 20 5 EIBDMO COc1ccccc1[C@@H]1CC[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173228974 1050357396 /nfs/dbraw/zinc/35/73/96/1050357396.db2.gz OWXKJYJRCFVPIA-NVXWUHKLSA-N 1 1 340.423 4.024 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2c(Cl)cccc2C1 ZINC001173232487 1050359497 /nfs/dbraw/zinc/35/94/97/1050359497.db2.gz HDMAFBPUABBXFR-CYBMUJFWSA-N 1 1 330.815 4.238 20 5 EIBDMO COc1cccc([C@@H]2CCC[N@H+]2[C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173234801 1050361391 /nfs/dbraw/zinc/36/13/91/1050361391.db2.gz UEQFQWHXKYFOEF-QRWLVFNGSA-N 1 1 340.423 4.372 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCc1ccc(Cl)cc1 ZINC001173235714 1050362266 /nfs/dbraw/zinc/36/22/66/1050362266.db2.gz YTVWIIRGFACHKY-CQSZACIVSA-N 1 1 332.831 4.354 20 5 EIBDMO CCCC[N@@H+](C)C[C@H](C)Nc1cccc(C(F)(F)F)c1[N+](=O)[O-] ZINC001186626879 1050370015 /nfs/dbraw/zinc/37/00/15/1050370015.db2.gz KTTZQWBVBWRZTR-NSHDSACASA-N 1 1 333.354 4.146 20 5 EIBDMO CC1(C)CCC[N@H+]1CCNc1c(Cl)c(Cl)ccc1[N+](=O)[O-] ZINC001186681659 1050399623 /nfs/dbraw/zinc/39/96/23/1050399623.db2.gz VSKHHAJGXPXIGN-UHFFFAOYSA-N 1 1 332.231 4.188 20 5 EIBDMO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C)c1c(C)noc1C ZINC000182458226 1050672667 /nfs/dbraw/zinc/67/26/67/1050672667.db2.gz SPZSBFSIEYMEFM-INIZCTEOSA-N 1 1 347.415 4.228 20 5 EIBDMO C[N@@H+](Cc1cc(Br)c([N+](=O)[O-])s1)C(C1CC1)C1CC1 ZINC001180006692 1050853440 /nfs/dbraw/zinc/85/34/40/1050853440.db2.gz JPPMTVCYUUYUDU-UHFFFAOYSA-N 1 1 345.262 4.039 20 5 EIBDMO C[C@@H](C1CC1)[N@@H+](Cc1cc(Br)c([N+](=O)[O-])s1)C1CC1 ZINC001180178006 1050894969 /nfs/dbraw/zinc/89/49/69/1050894969.db2.gz LBWGWYADEXOAMY-QMMMGPOBSA-N 1 1 345.262 4.182 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@@H]2Cc2ccc(F)cc2)c(F)c1 ZINC001180185522 1050897617 /nfs/dbraw/zinc/89/76/17/1050897617.db2.gz ZRWUYJRQSLLOLJ-QGZVFWFLSA-N 1 1 346.377 4.470 20 5 EIBDMO C[C@H]1CCC[C@@H]([N@@H+](C)Cc2cc(Br)c([N+](=O)[O-])s2)C1 ZINC001180392499 1050976557 /nfs/dbraw/zinc/97/65/57/1050976557.db2.gz FPRADFOEGBMSFJ-VHSXEESVSA-N 1 1 347.278 4.429 20 5 EIBDMO Cc1c([C@H](C)N[C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000183187955 1051016348 /nfs/dbraw/zinc/01/63/48/1051016348.db2.gz ILJIRWNARKBXSU-IXDOHACOSA-N 1 1 345.487 4.207 20 5 EIBDMO Cc1c([C@H](C)N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000183187955 1051016367 /nfs/dbraw/zinc/01/63/67/1051016367.db2.gz ILJIRWNARKBXSU-IXDOHACOSA-N 1 1 345.487 4.207 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](CCc1ccccc1)CC(C)C ZINC001190549826 1051213707 /nfs/dbraw/zinc/21/37/07/1051213707.db2.gz DLWCHBVTICHJRR-UHFFFAOYSA-N 1 1 342.439 4.304 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@@H]3CC3CCCCC3)nc2c1 ZINC001190642591 1051239430 /nfs/dbraw/zinc/23/94/30/1051239430.db2.gz DWQNQWWMODDVLK-OAHLLOKOSA-N 1 1 342.443 4.406 20 5 EIBDMO C[C@H](c1ccccn1)[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000183676662 1051254927 /nfs/dbraw/zinc/25/49/27/1051254927.db2.gz UDVAZXDKRHYNDE-CQSZACIVSA-N 1 1 337.379 4.443 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](CCSc1cccc(Cl)c1)CC2 ZINC001191521645 1051474660 /nfs/dbraw/zinc/47/46/60/1051474660.db2.gz URJLGFPECFEORQ-UHFFFAOYSA-N 1 1 348.855 4.399 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](CCSc1cccc(Cl)c1)CC2 ZINC001191521645 1051474663 /nfs/dbraw/zinc/47/46/63/1051474663.db2.gz URJLGFPECFEORQ-UHFFFAOYSA-N 1 1 348.855 4.399 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@@H](C)c1nccs1 ZINC000183928551 1051654204 /nfs/dbraw/zinc/65/42/04/1051654204.db2.gz WXPIJJFOIGYTBC-CYBMUJFWSA-N 1 1 349.456 4.074 20 5 EIBDMO C[C@]1(c2ccccc2)CCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC001175742448 1051751812 /nfs/dbraw/zinc/75/18/12/1051751812.db2.gz ZMIJIIQQTJZBCL-HXUWFJFHSA-N 1 1 340.423 4.375 20 5 EIBDMO Cc1nc(-c2ccccc2)oc1C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC001175890654 1051817396 /nfs/dbraw/zinc/81/73/96/1051817396.db2.gz JBTFLIGYDJNKBY-CYBMUJFWSA-N 1 1 337.379 4.409 20 5 EIBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CCc1ccc(Cl)cc1 ZINC001192857728 1051824438 /nfs/dbraw/zinc/82/44/38/1051824438.db2.gz FUGBJTSZIBDDJU-UHFFFAOYSA-N 1 1 348.830 4.192 20 5 EIBDMO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]2C ZINC001193271975 1051894407 /nfs/dbraw/zinc/89/44/07/1051894407.db2.gz CZQROORCQNJRSQ-KGLIPLIRSA-N 1 1 326.396 4.111 20 5 EIBDMO COc1ccc2c(c1)C[C@@H](C)[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]2C ZINC001193271975 1051894410 /nfs/dbraw/zinc/89/44/10/1051894410.db2.gz CZQROORCQNJRSQ-KGLIPLIRSA-N 1 1 326.396 4.111 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](c2ccc(C)cc2)C[C@@H]1C ZINC001193931168 1052024876 /nfs/dbraw/zinc/02/48/76/1052024876.db2.gz MLNOFISNVQCLSF-DOTOQJQBSA-N 1 1 340.423 4.290 20 5 EIBDMO CC[C@H](C)[C@H](C)[N@@H+]1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC001194291476 1052128964 /nfs/dbraw/zinc/12/89/64/1052128964.db2.gz OVNPKYOWMATUPV-QWRGUYRKSA-N 1 1 341.249 4.150 20 5 EIBDMO CC[C@H](C)[C@H](C)[N@H+]1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC001194291476 1052128971 /nfs/dbraw/zinc/12/89/71/1052128971.db2.gz OVNPKYOWMATUPV-QWRGUYRKSA-N 1 1 341.249 4.150 20 5 EIBDMO CN(CC[C@@H]1CCCC[N@H+]1C)c1c(Cl)c(Cl)ccc1[N+](=O)[O-] ZINC001185526821 1052257700 /nfs/dbraw/zinc/25/77/00/1052257700.db2.gz HMWJFMMDFMTZCZ-NSHDSACASA-N 1 1 346.258 4.212 20 5 EIBDMO C[C@H]1C[C@H](C(C)(C)C)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001194807735 1053107838 /nfs/dbraw/zinc/10/78/38/1053107838.db2.gz SYHXDVPNABPRAG-LSDHHAIUSA-N 1 1 347.459 4.070 20 5 EIBDMO Cc1cc(F)ccc1[C@H]1CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001195122248 1053282031 /nfs/dbraw/zinc/28/20/31/1053282031.db2.gz FMNCTGWBTGJHTE-LJQANCHMSA-N 1 1 344.386 4.258 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H]2O[C@@H](c3ccccc3)C[C@H]21 ZINC001195713693 1053468091 /nfs/dbraw/zinc/46/80/91/1053468091.db2.gz ZILWSZYXROZQNG-VAMGGRTRSA-N 1 1 338.407 4.089 20 5 EIBDMO Cc1ccc([C@@H]2CCCCC[N@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000776584731 1053560528 /nfs/dbraw/zinc/56/05/28/1053560528.db2.gz PKNBHDZLXTVBIS-ZWKOTPCHSA-N 1 1 344.411 4.147 20 5 EIBDMO CC1(C)CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC(C)(C)C1 ZINC001195994561 1053564707 /nfs/dbraw/zinc/56/47/07/1053564707.db2.gz DJDQKPWFHGFLJX-UHFFFAOYSA-N 1 1 347.459 4.072 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@@H]([C@H]3CCCCO3)C2)c1 ZINC000852596377 1053594945 /nfs/dbraw/zinc/59/49/45/1053594945.db2.gz LHLYVIYHZCBXEM-CXAGYDPISA-N 1 1 338.835 4.029 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@@H](C4CCC4)C3)co2)cc1 ZINC001196255293 1053619331 /nfs/dbraw/zinc/61/93/31/1053619331.db2.gz TZIFYFIYHHUFOS-MRXNPFEDSA-N 1 1 341.411 4.262 20 5 EIBDMO CC(C)C[N@H+](Cc1ccccn1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC001198001089 1054044249 /nfs/dbraw/zinc/04/42/49/1054044249.db2.gz MSQFLQWCLXEDOK-UHFFFAOYSA-N 1 1 333.819 4.301 20 5 EIBDMO CC(C)C[N@@H+](Cc1ccccn1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC001198001089 1054044257 /nfs/dbraw/zinc/04/42/57/1054044257.db2.gz MSQFLQWCLXEDOK-UHFFFAOYSA-N 1 1 333.819 4.301 20 5 EIBDMO C[C@]1(Cc2cccs2)CCC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC001198299038 1054118101 /nfs/dbraw/zinc/11/81/01/1054118101.db2.gz CQFRERXIYYTBOQ-QGZVFWFLSA-N 1 1 334.416 4.393 20 5 EIBDMO CCN(C)c1ccccc1C[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872033759 1054349320 /nfs/dbraw/zinc/34/93/20/1054349320.db2.gz JEHBBZXYHZVPGW-CYBMUJFWSA-N 1 1 331.391 4.041 20 5 EIBDMO CCCc1nc(C)c(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2SC)o1 ZINC000872072762 1054379438 /nfs/dbraw/zinc/37/94/38/1054379438.db2.gz JRJQIQFZLLERQW-LLVKDONJSA-N 1 1 349.456 4.416 20 5 EIBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1COCc2ccccc21 ZINC000872079828 1054381026 /nfs/dbraw/zinc/38/10/26/1054381026.db2.gz LCIFEIJNMDJZAO-SJKOYZFVSA-N 1 1 344.436 4.239 20 5 EIBDMO CCn1c2ccccc2nc1[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000173428780 1054948328 /nfs/dbraw/zinc/94/83/28/1054948328.db2.gz QBXDHHIYXXSDRC-KBPBESRZSA-N 1 1 338.411 4.376 20 5 EIBDMO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1nc2c(s1)CCCC2 ZINC000173427181 1054951294 /nfs/dbraw/zinc/95/12/94/1054951294.db2.gz KMFLOEXCJHXUKM-RYUDHWBXSA-N 1 1 331.441 4.342 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2cc(C(F)(F)F)co2)cc1[N+](=O)[O-] ZINC000878371785 1055279561 /nfs/dbraw/zinc/27/95/61/1055279561.db2.gz QPSKSHRALSJDQI-SNVBAGLBSA-N 1 1 328.290 4.366 20 5 EIBDMO C[C@@H](NC[C@@H](c1ccccc1)[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000326784570 1055520979 /nfs/dbraw/zinc/52/09/79/1055520979.db2.gz VLOMTXCGWPJHDY-UZLBHIALSA-N 1 1 339.439 4.083 20 5 EIBDMO CCC(CC)C[N@@H+](CC)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000153879733 1056689670 /nfs/dbraw/zinc/68/96/70/1056689670.db2.gz KNTUYWHPCUMPQV-CYBMUJFWSA-N 1 1 346.431 4.464 20 5 EIBDMO CC[N@@H+]1CCCC[C@@H]1C(=O)OCc1nc2ccccc2c2ccccc12 ZINC000745089259 1059719835 /nfs/dbraw/zinc/71/98/35/1059719835.db2.gz QNIQOHJNWMTMEW-OAQYLSRUSA-N 1 1 348.446 4.306 20 5 EIBDMO CC[N@H+]1CCCC[C@@H]1C(=O)OCc1nc2ccccc2c2ccccc12 ZINC000745089259 1059719865 /nfs/dbraw/zinc/71/98/65/1059719865.db2.gz QNIQOHJNWMTMEW-OAQYLSRUSA-N 1 1 348.446 4.306 20 5 EIBDMO C[N@@H+](Cc1sc2ccccc2c1Cl)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169035785 1060590736 /nfs/dbraw/zinc/59/07/36/1060590736.db2.gz CGKHEORLQIZHLI-RYUDHWBXSA-N 1 1 338.860 4.432 20 5 EIBDMO CC(C)(C)Oc1ccc([C@@H]2CC[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)cc1 ZINC001169055821 1060609604 /nfs/dbraw/zinc/60/96/04/1060609604.db2.gz QOGQSFIXGXMLTK-KBAYOESNSA-N 1 1 346.471 4.099 20 5 EIBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CCC=C(C)C2)cc1OC ZINC001169761285 1060948316 /nfs/dbraw/zinc/94/83/16/1060948316.db2.gz HGRXEBMTYOMWRP-AWEZNQCLSA-N 1 1 348.443 4.180 20 5 EIBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CCC=C(C)C2)cc1OC ZINC001169761285 1060948336 /nfs/dbraw/zinc/94/83/36/1060948336.db2.gz HGRXEBMTYOMWRP-AWEZNQCLSA-N 1 1 348.443 4.180 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCCSCC2)s1 ZINC000508623981 1032283344 /nfs/dbraw/zinc/28/33/44/1032283344.db2.gz SUUJKKARDLWRBV-UHFFFAOYSA-N 1 1 334.466 4.262 20 5 EIBDMO CC(C)[C@H]1CCCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000532974656 1032432793 /nfs/dbraw/zinc/43/27/93/1032432793.db2.gz UMLXNSPYNMBNKF-QGZVFWFLSA-N 1 1 343.427 4.303 20 5 EIBDMO C[C@@H]1CCC[C@@H](C)[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000533432028 1032759412 /nfs/dbraw/zinc/75/94/12/1032759412.db2.gz TZNRYTJPZWDBAJ-HUUCEWRRSA-N 1 1 343.427 4.303 20 5 EIBDMO CC[C@@H]1CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000509532291 1032785597 /nfs/dbraw/zinc/78/55/97/1032785597.db2.gz JKTUIBDJVKWABB-CYBMUJFWSA-N 1 1 331.441 4.340 20 5 EIBDMO CSC[C@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000430189339 1019065423 /nfs/dbraw/zinc/06/54/23/1019065423.db2.gz DCJRZIXIDIZEBC-AWEZNQCLSA-N 1 1 346.452 4.430 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)c1cc2ccccc2o1 ZINC000430192586 1019092804 /nfs/dbraw/zinc/09/28/04/1019092804.db2.gz CGINYOLRDSALPA-GFCCVEGCSA-N 1 1 326.352 4.200 20 5 EIBDMO CSC[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000430193543 1019106812 /nfs/dbraw/zinc/10/68/12/1019106812.db2.gz FNXRZFBYGLMOCM-CQSZACIVSA-N 1 1 346.452 4.430 20 5 EIBDMO COc1ccc(C[N@H+]2CC[C@@H](c3ccccc3)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000610216030 1019388317 /nfs/dbraw/zinc/38/83/17/1019388317.db2.gz DVUGPMRKZXBFST-CRAIPNDOSA-N 1 1 340.423 4.229 20 5 EIBDMO COc1ccc(C[C@H]2CCC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000610217351 1019430426 /nfs/dbraw/zinc/43/04/26/1019430426.db2.gz JCGLOISKFCZSEM-QGZVFWFLSA-N 1 1 340.423 4.058 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000609705060 1020035281 /nfs/dbraw/zinc/03/52/81/1020035281.db2.gz LSTRLBCTKZTGBW-SFHVURJKSA-N 1 1 346.814 4.212 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000609705060 1020035290 /nfs/dbraw/zinc/03/52/90/1020035290.db2.gz LSTRLBCTKZTGBW-SFHVURJKSA-N 1 1 346.814 4.212 20 5 EIBDMO CCC[N@@H+](CC1CCCCC1)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC001167146129 1020367109 /nfs/dbraw/zinc/36/71/09/1020367109.db2.gz KZVKDWRHCHEGJI-HNNXBMFYSA-N 1 1 347.459 4.214 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1Br)[C@@H](C)C(C)C ZINC001167240830 1020648609 /nfs/dbraw/zinc/64/86/09/1020648609.db2.gz LHIBGTZAKPACNN-NSHDSACASA-N 1 1 329.238 4.224 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH+]3CC4(CCC4(F)F)C3)o2)c1 ZINC000580254031 1021805436 /nfs/dbraw/zinc/80/54/36/1021805436.db2.gz VEGJXEDFTLGGSE-UHFFFAOYSA-N 1 1 334.322 4.086 20 5 EIBDMO COc1cccc(Cl)c1C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000581082169 1021829524 /nfs/dbraw/zinc/82/95/24/1021829524.db2.gz KHLBQAKJCXQVGU-OAHLLOKOSA-N 1 1 332.787 4.034 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000581230418 1021837785 /nfs/dbraw/zinc/83/77/85/1021837785.db2.gz DUKCIEYNNVEWNI-VDBIKXPHSA-N 1 1 328.334 4.272 20 5 EIBDMO CCC[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@@H]1CCCCO1 ZINC000581392288 1021850001 /nfs/dbraw/zinc/85/00/01/1021850001.db2.gz QEZHNNBFVTUVGP-HNNXBMFYSA-N 1 1 326.824 4.029 20 5 EIBDMO Cc1c(NC(=O)CC[N@H+](CC(C)C)C2CCCC2)cccc1[N+](=O)[O-] ZINC000582199176 1021928171 /nfs/dbraw/zinc/92/81/71/1021928171.db2.gz MUGYTGZXLCPHFL-UHFFFAOYSA-N 1 1 347.459 4.132 20 5 EIBDMO C[C@H]1CCC(C)(C)[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000452012701 1022214104 /nfs/dbraw/zinc/21/41/04/1022214104.db2.gz SHYRBWJIIYJKMO-ZDUSSCGKSA-N 1 1 329.400 4.055 20 5 EIBDMO C[C@H]([NH2+]Cc1nc2ccccc2n1C(F)F)c1cccc([N+](=O)[O-])c1 ZINC000180394534 1022627129 /nfs/dbraw/zinc/62/71/29/1022627129.db2.gz RJSDZBOZNSTTFN-NSHDSACASA-N 1 1 346.337 4.190 20 5 EIBDMO CC[C@@H](C)C[N@@H+](CC)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000177850387 1022645096 /nfs/dbraw/zinc/64/50/96/1022645096.db2.gz DKVNKPGFKLWGAG-CQSZACIVSA-N 1 1 331.416 4.160 20 5 EIBDMO CCCc1ncc(C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)o1 ZINC000417351993 1023289279 /nfs/dbraw/zinc/28/92/79/1023289279.db2.gz TYPANUYVOIMFFC-QGZVFWFLSA-N 1 1 329.400 4.093 20 5 EIBDMO C[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1nccn1-c1ccccc1 ZINC000376802735 1023314035 /nfs/dbraw/zinc/31/40/35/1023314035.db2.gz SJEOVEBAPWUILS-GJZGRUSLSA-N 1 1 336.395 4.192 20 5 EIBDMO CCOC[C@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000126578359 1023371414 /nfs/dbraw/zinc/37/14/14/1023371414.db2.gz YSLJMXJIWXOLGV-HNNXBMFYSA-N 1 1 344.411 4.103 20 5 EIBDMO CC[C@H](C)[C@@H](C)[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000566519255 1023445574 /nfs/dbraw/zinc/44/55/74/1023445574.db2.gz IENNQEDZMBTLPV-DZGCQCFKSA-N 1 1 347.459 4.131 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@@H]2Cc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000500172613 1023565784 /nfs/dbraw/zinc/56/57/84/1023565784.db2.gz NMEVVGDJHIUICJ-GOSISDBHSA-N 1 1 340.423 4.119 20 5 EIBDMO CC(C)[N@H+](CCc1nccs1)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000119539657 1023676949 /nfs/dbraw/zinc/67/69/49/1023676949.db2.gz GJZXYCDVPDQPQT-UHFFFAOYSA-N 1 1 339.848 4.158 20 5 EIBDMO CC(C)[N@@H+](CCc1nccs1)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000119539657 1023676962 /nfs/dbraw/zinc/67/69/62/1023676962.db2.gz GJZXYCDVPDQPQT-UHFFFAOYSA-N 1 1 339.848 4.158 20 5 EIBDMO CSCC[C@@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000566810003 1023822641 /nfs/dbraw/zinc/82/26/41/1023822641.db2.gz YCYVAYYVZKCWPJ-SNVBAGLBSA-N 1 1 336.379 4.187 20 5 EIBDMO CC[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccc(C)cc1 ZINC000181692018 1023961387 /nfs/dbraw/zinc/96/13/87/1023961387.db2.gz CUOQZBXRDAIPPZ-OAHLLOKOSA-N 1 1 325.368 4.285 20 5 EIBDMO CC(C)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccc(F)cc1 ZINC000610581554 1024104219 /nfs/dbraw/zinc/10/42/19/1024104219.db2.gz SOAYMRSEQKBMFQ-UHFFFAOYSA-N 1 1 343.358 4.286 20 5 EIBDMO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610580823 1024107008 /nfs/dbraw/zinc/10/70/08/1024107008.db2.gz QYTMBWHVOMAMMV-NSHDSACASA-N 1 1 329.331 4.068 20 5 EIBDMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610580823 1024107031 /nfs/dbraw/zinc/10/70/31/1024107031.db2.gz QYTMBWHVOMAMMV-NSHDSACASA-N 1 1 329.331 4.068 20 5 EIBDMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000610581152 1024114253 /nfs/dbraw/zinc/11/42/53/1024114253.db2.gz GKPBFMXBILBCCQ-CYBMUJFWSA-N 1 1 325.368 4.237 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCO[C@@H]4CCC[C@H]43)s2)cc1 ZINC000510649864 1024163865 /nfs/dbraw/zinc/16/38/65/1024163865.db2.gz YPSOJFSZLWQXOQ-IAGOWNOFSA-N 1 1 344.436 4.077 20 5 EIBDMO Cn1cccc1[C@H]1CCCC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000538725521 1025514952 /nfs/dbraw/zinc/51/49/52/1025514952.db2.gz ZYAXRUDODSWLFB-WMHRWZGDSA-N 1 1 325.412 4.174 20 5 EIBDMO C[N@H+]1CC[C@H](Nc2ccnc3c2cccc3[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000432334809 1025649696 /nfs/dbraw/zinc/64/96/96/1025649696.db2.gz KMEAXGYKCRHSSF-FXAWDEMLSA-N 1 1 348.406 4.000 20 5 EIBDMO CC[C@@H]([NH2+]Cc1nc2ccc(F)cc2o1)c1cccc([N+](=O)[O-])c1 ZINC000342276541 1025750159 /nfs/dbraw/zinc/75/01/59/1025750159.db2.gz CVFUQAFJYAZIGY-CQSZACIVSA-N 1 1 329.331 4.116 20 5 EIBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)C12CCCCC2 ZINC001167538883 1025996889 /nfs/dbraw/zinc/99/68/89/1025996889.db2.gz FZFMBAHHQMXZNR-RTBURBONSA-N 1 1 346.471 4.463 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(OC3CCCC3)CC2)c(Cl)c1 ZINC000182104186 1026264612 /nfs/dbraw/zinc/26/46/12/1026264612.db2.gz CRPKWAVUAJGUOU-UHFFFAOYSA-N 1 1 338.835 4.172 20 5 EIBDMO CC(C)C[C@H]1CCC[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000507134794 1026665182 /nfs/dbraw/zinc/66/51/82/1026665182.db2.gz OKECXUXXUNLRLR-GOSISDBHSA-N 1 1 342.443 4.006 20 5 EIBDMO C[C@H](CC[N@@H+](C)CCc1ccccc1[N+](=O)[O-])OCc1ccccc1 ZINC000511138847 1026711997 /nfs/dbraw/zinc/71/19/97/1026711997.db2.gz GVSSVPXVQADJJN-QGZVFWFLSA-N 1 1 342.439 4.065 20 5 EIBDMO COc1ccc([C@@H]2CC[N@@H+](C/C=C\c3ccccc3[N+](=O)[O-])C2)cc1 ZINC000512339360 1026740344 /nfs/dbraw/zinc/74/03/44/1026740344.db2.gz UMSLFHLANMFLBP-WLPBJKJWSA-N 1 1 338.407 4.106 20 5 EIBDMO CCOc1cc(N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)ccc1[N+](=O)[O-] ZINC000302067149 1026741568 /nfs/dbraw/zinc/74/15/68/1026741568.db2.gz WODZTVBPCLTOBV-GJZGRUSLSA-N 1 1 347.459 4.058 20 5 EIBDMO COc1ccc(-c2ccc(C[N@@H+](C)[C@@H](C)C3CC3)o2)c([N+](=O)[O-])c1 ZINC000507442602 1026795417 /nfs/dbraw/zinc/79/54/17/1026795417.db2.gz RZASTECQRYZJDJ-LBPRGKRZSA-N 1 1 330.384 4.094 20 5 EIBDMO COc1ccc(-c2ccc(C[N@@H+](C)[C@H](C)C3CC3)o2)c([N+](=O)[O-])c1 ZINC000507442601 1026795824 /nfs/dbraw/zinc/79/58/24/1026795824.db2.gz RZASTECQRYZJDJ-GFCCVEGCSA-N 1 1 330.384 4.094 20 5 EIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@H](COc2ccccc2)C1 ZINC000507706234 1026882030 /nfs/dbraw/zinc/88/20/30/1026882030.db2.gz GWYQPYMVTCLHPF-JKNJVXJCSA-N 1 1 338.407 4.009 20 5 EIBDMO CCOc1ccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C(C)C)cc1 ZINC000519909404 1027042706 /nfs/dbraw/zinc/04/27/06/1027042706.db2.gz VYLUMSYJCDGSCR-UHFFFAOYSA-N 1 1 328.412 4.404 20 5 EIBDMO C[C@H]1C[C@H](c2cccc(F)c2)[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000441323757 1027448097 /nfs/dbraw/zinc/44/80/97/1027448097.db2.gz OGEQIEOMXCWLMF-IFXJQAMLSA-N 1 1 328.387 4.360 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000441379200 1027503400 /nfs/dbraw/zinc/50/34/00/1027503400.db2.gz FIAGQGNEDIMUSI-HOCLYGCPSA-N 1 1 328.387 4.360 20 5 EIBDMO COc1ccccc1[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000441406647 1027543226 /nfs/dbraw/zinc/54/32/26/1027543226.db2.gz YHUMRHVHDNEODF-LSDHHAIUSA-N 1 1 326.396 4.154 20 5 EIBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@]1(C)CC1(Cl)Cl ZINC001168042680 1027556550 /nfs/dbraw/zinc/55/65/50/1027556550.db2.gz GBTXRVJHOUTIQJ-LBPRGKRZSA-N 1 1 337.634 4.264 20 5 EIBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@]1(C)CC1(Cl)Cl ZINC001168042680 1027556561 /nfs/dbraw/zinc/55/65/61/1027556561.db2.gz GBTXRVJHOUTIQJ-LBPRGKRZSA-N 1 1 337.634 4.264 20 5 EIBDMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000444660188 1027930907 /nfs/dbraw/zinc/93/09/07/1027930907.db2.gz IXAQDPWKZIFWKZ-CJNGLKHVSA-N 1 1 344.415 4.045 20 5 EIBDMO CC[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H]1CCCC[C@H]1C ZINC000444666399 1027948508 /nfs/dbraw/zinc/94/85/08/1027948508.db2.gz SHUNGKQTCMAHEO-CJNGLKHVSA-N 1 1 344.415 4.045 20 5 EIBDMO CC(C)[C@H]1CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000444754524 1028039835 /nfs/dbraw/zinc/03/98/35/1028039835.db2.gz MGKJFPUCAUGXQR-INIZCTEOSA-N 1 1 343.427 4.160 20 5 EIBDMO CC[C@H](c1cccc(OC)c1)[N@@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000583432780 1028726023 /nfs/dbraw/zinc/72/60/23/1028726023.db2.gz ALLYRTWKZXOUCO-QGZVFWFLSA-N 1 1 344.411 4.195 20 5 EIBDMO Cc1nn(C(C)C)cc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000281563377 1028778558 /nfs/dbraw/zinc/77/85/58/1028778558.db2.gz JYEVYEVVINNWNM-UHFFFAOYSA-N 1 1 330.432 4.091 20 5 EIBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])Cc1ccc(Cl)c2cccnc12 ZINC000052589528 1029195790 /nfs/dbraw/zinc/19/57/90/1029195790.db2.gz RRXYRPKHEBUPOQ-UHFFFAOYSA-N 1 1 341.798 4.428 20 5 EIBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])Cc1ccc(Cl)c2cccnc12 ZINC000052589528 1029195796 /nfs/dbraw/zinc/19/57/96/1029195796.db2.gz RRXYRPKHEBUPOQ-UHFFFAOYSA-N 1 1 341.798 4.428 20 5 EIBDMO Cc1c(C[N@H+]2CC[C@H](Cc3ccc(F)cc3)C2)cccc1[N+](=O)[O-] ZINC000523007648 1029345609 /nfs/dbraw/zinc/34/56/09/1029345609.db2.gz UHQJINUEWJYQKC-MRXNPFEDSA-N 1 1 328.387 4.107 20 5 EIBDMO CCc1ccc([C@@H]([NH2+]CCOC(C)(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544381178 1029456504 /nfs/dbraw/zinc/45/65/04/1029456504.db2.gz ZGVZNXWZZPBLSL-SFHVURJKSA-N 1 1 346.427 4.244 20 5 EIBDMO COc1cccc(Cl)c1C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447603119 1030225926 /nfs/dbraw/zinc/22/59/26/1030225926.db2.gz WSFQVPFFEKSFMQ-KRWDZBQOSA-N 1 1 346.814 4.424 20 5 EIBDMO Cc1ccc2cc(C[N@@H+]3CCc4c(cccc4[N+](=O)[O-])C3)ccc2n1 ZINC000526124470 1030303405 /nfs/dbraw/zinc/30/34/05/1030303405.db2.gz OFVRSQKRVOKOKQ-UHFFFAOYSA-N 1 1 333.391 4.010 20 5 EIBDMO Cc1ccc2cc(C[N@H+]3CCc4c(cccc4[N+](=O)[O-])C3)ccc2n1 ZINC000526124470 1030303421 /nfs/dbraw/zinc/30/34/21/1030303421.db2.gz OFVRSQKRVOKOKQ-UHFFFAOYSA-N 1 1 333.391 4.010 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3nc4ccccc4o3)C2)cc1 ZINC000451544824 1030563749 /nfs/dbraw/zinc/56/37/49/1030563749.db2.gz FXLZSGSJQNKZCP-HNNXBMFYSA-N 1 1 337.379 4.116 20 5 EIBDMO CC(C)(C)c1cnc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000451551314 1030570564 /nfs/dbraw/zinc/57/05/64/1030570564.db2.gz UGGAARUDCVRSEW-HNNXBMFYSA-N 1 1 343.427 4.260 20 5 EIBDMO CC(C)(C)c1cnc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000451551314 1030570584 /nfs/dbraw/zinc/57/05/84/1030570584.db2.gz UGGAARUDCVRSEW-HNNXBMFYSA-N 1 1 343.427 4.260 20 5 EIBDMO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1cc(C)ccc1OC ZINC000179424214 1031060638 /nfs/dbraw/zinc/06/06/38/1031060638.db2.gz VBFAVCUPBHWIAH-QGZVFWFLSA-N 1 1 344.411 4.161 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[NH2+][C@H](c3cccs3)C3CC3)nc2c1 ZINC000612457940 1031547085 /nfs/dbraw/zinc/54/70/85/1031547085.db2.gz DIGDGEFKGLHREW-INIZCTEOSA-N 1 1 329.381 4.038 20 5 EIBDMO COC[C@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000449778385 1032001992 /nfs/dbraw/zinc/00/19/92/1032001992.db2.gz RZXPYVKGGGCJLQ-HNNXBMFYSA-N 1 1 344.411 4.103 20 5 EIBDMO CC(C)C1CCC([N@@H+](C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000433026263 1033686916 /nfs/dbraw/zinc/68/69/16/1033686916.db2.gz DLFYPMJHCJXFLG-UHFFFAOYSA-N 1 1 348.443 4.108 20 5 EIBDMO CC[NH+](CC)Cc1ccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000120506966 1034058810 /nfs/dbraw/zinc/05/88/10/1034058810.db2.gz PZTNKYNTMJTJEC-INIZCTEOSA-N 1 1 341.455 4.287 20 5 EIBDMO C[C@H](c1ccc(OC(F)F)cc1)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000513682975 1035100103 /nfs/dbraw/zinc/10/01/03/1035100103.db2.gz DPSHILPKYJFPGX-GFCCVEGCSA-N 1 1 336.338 4.389 20 5 EIBDMO C[C@@H](c1ccc(OC(F)F)cc1)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000513682976 1035100444 /nfs/dbraw/zinc/10/04/44/1035100444.db2.gz DPSHILPKYJFPGX-LBPRGKRZSA-N 1 1 336.338 4.389 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183194375 1035337030 /nfs/dbraw/zinc/33/70/30/1035337030.db2.gz PXWRKSHUKXJITK-IXDOHACOSA-N 1 1 345.487 4.207 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183194375 1035337037 /nfs/dbraw/zinc/33/70/37/1035337037.db2.gz PXWRKSHUKXJITK-IXDOHACOSA-N 1 1 345.487 4.207 20 5 EIBDMO COc1ccc(F)cc1[C@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595014841 1035508207 /nfs/dbraw/zinc/50/82/07/1035508207.db2.gz UQAHTGZBUCYYBM-RYUDHWBXSA-N 1 1 348.374 4.163 20 5 EIBDMO CC(C)[C@H](O)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000594988665 1035521404 /nfs/dbraw/zinc/52/14/04/1035521404.db2.gz ASINDYXDXWQIEJ-ROUUACIJSA-N 1 1 348.830 4.096 20 5 EIBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1cccc(OC2CC2)c1F ZINC000595070198 1035549489 /nfs/dbraw/zinc/54/94/89/1035549489.db2.gz UBSCXULSDGMPMF-INIZCTEOSA-N 1 1 342.370 4.052 20 5 EIBDMO C[C@H]([NH2+]Cc1cc(F)ccc1OC(F)F)c1ccccc1[N+](=O)[O-] ZINC000595093294 1035598760 /nfs/dbraw/zinc/59/87/60/1035598760.db2.gz HOZVJVQCYNWHQX-JTQLQIEISA-N 1 1 340.301 4.186 20 5 EIBDMO Cc1noc(C[N@H+]2Cc3ccccc3[C@H](c3ccccc3)C2)c1[N+](=O)[O-] ZINC000595288633 1035630705 /nfs/dbraw/zinc/63/07/05/1035630705.db2.gz QOEZDMJCQPDZJK-SFHVURJKSA-N 1 1 349.390 4.039 20 5 EIBDMO Cc1noc(C[N@@H+]2Cc3ccccc3[C@H](c3ccccc3)C2)c1[N+](=O)[O-] ZINC000595288633 1035630731 /nfs/dbraw/zinc/63/07/31/1035630731.db2.gz QOEZDMJCQPDZJK-SFHVURJKSA-N 1 1 349.390 4.039 20 5 EIBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCS[C@H](c2ccccc2)C1 ZINC000595318258 1035638966 /nfs/dbraw/zinc/63/89/66/1035638966.db2.gz IGLLJASMTVBBSS-KRWDZBQOSA-N 1 1 332.400 4.024 20 5 EIBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCS[C@H](c2ccccc2)C1 ZINC000595318258 1035638977 /nfs/dbraw/zinc/63/89/77/1035638977.db2.gz IGLLJASMTVBBSS-KRWDZBQOSA-N 1 1 332.400 4.024 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(COc3ccccc3)CC2)c(F)c1 ZINC000491133556 1035816521 /nfs/dbraw/zinc/81/65/21/1035816521.db2.gz DRKQOGAFXKUNPL-UHFFFAOYSA-N 1 1 344.386 4.025 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CCCC(=O)OC(C)(C)C ZINC000485458934 1035893597 /nfs/dbraw/zinc/89/35/97/1035893597.db2.gz SQYOQXKMVLJHOR-CQSZACIVSA-N 1 1 336.432 4.018 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000596590297 1035910540 /nfs/dbraw/zinc/91/05/40/1035910540.db2.gz CMAVGXKFAOEDEJ-KDOFPFPSSA-N 1 1 325.412 4.442 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000596590297 1035910557 /nfs/dbraw/zinc/91/05/57/1035910557.db2.gz CMAVGXKFAOEDEJ-KDOFPFPSSA-N 1 1 325.412 4.442 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cc3ccncc3s2)C2CC2)c1 ZINC000596979965 1036062769 /nfs/dbraw/zinc/06/27/69/1036062769.db2.gz QRZYAWYPWQOXGO-UHFFFAOYSA-N 1 1 339.420 4.369 20 5 EIBDMO CC[N@H+](Cc1ccc(Cl)s1)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000485715822 1036203579 /nfs/dbraw/zinc/20/35/79/1036203579.db2.gz KFOMIUYHNRNENA-UHFFFAOYSA-N 1 1 340.832 4.340 20 5 EIBDMO CC[N@@H+](Cc1ccc(Cl)s1)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000485715822 1036203606 /nfs/dbraw/zinc/20/36/06/1036203606.db2.gz KFOMIUYHNRNENA-UHFFFAOYSA-N 1 1 340.832 4.340 20 5 EIBDMO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000485776110 1036255704 /nfs/dbraw/zinc/25/57/04/1036255704.db2.gz WKEKUSHWXODWSV-MRXNPFEDSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1cc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000485776110 1036255722 /nfs/dbraw/zinc/25/57/22/1036255722.db2.gz WKEKUSHWXODWSV-MRXNPFEDSA-N 1 1 330.359 4.080 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000485825237 1036306773 /nfs/dbraw/zinc/30/67/73/1036306773.db2.gz MQVTWIPAOYFNBE-GQIGUUNPSA-N 1 1 340.423 4.426 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000485825237 1036306794 /nfs/dbraw/zinc/30/67/94/1036306794.db2.gz MQVTWIPAOYFNBE-GQIGUUNPSA-N 1 1 340.423 4.426 20 5 EIBDMO COc1ccc2c(c1)C[N@H+]([C@@H](C)c1cc([N+](=O)[O-])ccc1C)CC2 ZINC000485825273 1036308589 /nfs/dbraw/zinc/30/85/89/1036308589.db2.gz MUMHDEFXPABDQT-AWEZNQCLSA-N 1 1 326.396 4.031 20 5 EIBDMO COc1ccc2c(c1)C[N@@H+]([C@@H](C)c1cc([N+](=O)[O-])ccc1C)CC2 ZINC000485825273 1036308601 /nfs/dbraw/zinc/30/86/01/1036308601.db2.gz MUMHDEFXPABDQT-AWEZNQCLSA-N 1 1 326.396 4.031 20 5 EIBDMO Cc1ccc(C2([NH2+]Cc3nc4cc([N+](=O)[O-])ccc4o3)CCC2)cc1 ZINC000602705071 1036583177 /nfs/dbraw/zinc/58/31/77/1036583177.db2.gz ZHOZAFPUOKGGFW-UHFFFAOYSA-N 1 1 337.379 4.213 20 5 EIBDMO CCC[N@@H+](CCc1ccccn1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000589195861 1036703647 /nfs/dbraw/zinc/70/36/47/1036703647.db2.gz POIXYTQEAGYZKD-UHFFFAOYSA-N 1 1 333.819 4.098 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCc2ccccc2)Cc2ccncc2)c1 ZINC000589194407 1036703919 /nfs/dbraw/zinc/70/39/19/1036703919.db2.gz MPCISXDVXANWKX-UHFFFAOYSA-N 1 1 347.418 4.235 20 5 EIBDMO COc1ccc2c(c1)C1(CC1)C[N@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000572651649 1036806051 /nfs/dbraw/zinc/80/60/51/1036806051.db2.gz KMBDTWMSBVFABX-AWEZNQCLSA-N 1 1 338.407 4.212 20 5 EIBDMO COc1ccc2c(c1)C1(CC1)C[N@@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000572651649 1036806052 /nfs/dbraw/zinc/80/60/52/1036806052.db2.gz KMBDTWMSBVFABX-AWEZNQCLSA-N 1 1 338.407 4.212 20 5 EIBDMO CCCCC[C@H]1CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000486795177 1036856248 /nfs/dbraw/zinc/85/62/48/1036856248.db2.gz QCNPIZWCBAQKSV-HNNXBMFYSA-N 1 1 344.415 4.190 20 5 EIBDMO COc1ccc(C[N@@H+](C)Cc2ccc3ccccc3c2)cc1[N+](=O)[O-] ZINC000603844758 1037037693 /nfs/dbraw/zinc/03/76/93/1037037693.db2.gz YRUHQMQJIYHZRO-UHFFFAOYSA-N 1 1 336.391 4.389 20 5 EIBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCCCC[C@H]2c2ccncc2)cc1 ZINC000603879279 1037071571 /nfs/dbraw/zinc/07/15/71/1037071571.db2.gz ONBWAJKWYWTMHN-IBGZPJMESA-N 1 1 325.412 4.150 20 5 EIBDMO Cc1cccc([C@@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])c1 ZINC000604016819 1037150022 /nfs/dbraw/zinc/15/00/22/1037150022.db2.gz FAFVPKVOSKAGRJ-KRWDZBQOSA-N 1 1 326.396 4.119 20 5 EIBDMO COc1cccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)CC(C)C)c1 ZINC000604494661 1037405762 /nfs/dbraw/zinc/40/57/62/1037405762.db2.gz TZDXEKPGTZXOIG-UHFFFAOYSA-N 1 1 328.412 4.262 20 5 EIBDMO C[C@H]1C[C@@]1([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000503402615 1037738294 /nfs/dbraw/zinc/73/82/94/1037738294.db2.gz BKYFIFKCLIIPEL-GTNSWQLSSA-N 1 1 334.778 4.412 20 5 EIBDMO COc1cc(C[NH2+]C2(c3ccccc3Cl)CC2)ccc1[N+](=O)[O-] ZINC000592137126 1037751151 /nfs/dbraw/zinc/75/11/51/1037751151.db2.gz DCGJWSQURFNFOF-UHFFFAOYSA-N 1 1 332.787 4.036 20 5 EIBDMO CCCO[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000172179798 1037888365 /nfs/dbraw/zinc/88/83/65/1037888365.db2.gz ALGFMYDNYWJQRE-OAHLLOKOSA-N 1 1 326.824 4.029 20 5 EIBDMO C[C@@H](N[C@H]1CC[NH2+][C@H](C)C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423381308 1038194104 /nfs/dbraw/zinc/19/41/04/1038194104.db2.gz OJHASBMKGWFRQU-MCIONIFRSA-N 1 1 345.468 4.114 20 5 EIBDMO C[C@@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)c1ccc([N+](=O)[O-])cc1 ZINC000504376352 1038340749 /nfs/dbraw/zinc/34/07/49/1038340749.db2.gz JMVXGSHZWLRYCI-CYBMUJFWSA-N 1 1 329.400 4.018 20 5 EIBDMO C[N@@H+](CCCNc1ccc2ncccc2c1[N+](=O)[O-])C1CCCCC1 ZINC000059369237 1038497775 /nfs/dbraw/zinc/49/77/75/1038497775.db2.gz SONOQHNFPCHOBH-UHFFFAOYSA-N 1 1 342.443 4.210 20 5 EIBDMO CCC[C@@H]([NH2+]Cc1cn2cc(C)ccc2n1)c1cccc([N+](=O)[O-])c1 ZINC000555121298 1038876220 /nfs/dbraw/zinc/87/62/20/1038876220.db2.gz ATAGPZAGKITIPW-GOSISDBHSA-N 1 1 338.411 4.182 20 5 EIBDMO COc1ccccc1[C@H]1CC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000537615049 1038896516 /nfs/dbraw/zinc/89/65/16/1038896516.db2.gz JZJKMCMWQSOMSE-QLBOMPFWSA-N 1 1 338.407 4.106 20 5 EIBDMO CC[C@H](C)[N@H+](C)CCNCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000608910903 1038949850 /nfs/dbraw/zinc/94/98/50/1038949850.db2.gz VWONUVPDECSGGW-AWEZNQCLSA-N 1 1 347.484 4.143 20 5 EIBDMO CC[C@H](C)[N@@H+](C)CCNCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000608910903 1038949879 /nfs/dbraw/zinc/94/98/79/1038949879.db2.gz VWONUVPDECSGGW-AWEZNQCLSA-N 1 1 347.484 4.143 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1C ZINC000534336656 1039347546 /nfs/dbraw/zinc/34/75/46/1039347546.db2.gz AYRXBWRVXGXZHY-UHFFFAOYSA-N 1 1 326.396 4.076 20 5 EIBDMO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1cccc([N+](=O)[O-])c1C)CCC2 ZINC000478052786 1039360884 /nfs/dbraw/zinc/36/08/84/1039360884.db2.gz IBXAPRUPVACBBB-INIZCTEOSA-N 1 1 345.468 4.432 20 5 EIBDMO C[C@H](c1ccccc1)[N@@H+]1CC[C@H](N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000482314541 1040167144 /nfs/dbraw/zinc/16/71/44/1040167144.db2.gz KAZUFHRIVPBCSY-FCEWJHQRSA-N 1 1 339.439 4.081 20 5 EIBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000482314541 1040167168 /nfs/dbraw/zinc/16/71/68/1040167168.db2.gz KAZUFHRIVPBCSY-FCEWJHQRSA-N 1 1 339.439 4.081 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3nc4ccccc4o3)C2)cc1 ZINC000029833348 1040465870 /nfs/dbraw/zinc/46/58/70/1040465870.db2.gz GWNOXCWIFVWUDE-HNNXBMFYSA-N 1 1 337.379 4.116 20 5 EIBDMO C[C@@H](NC(C)(C)C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000482955523 1040601824 /nfs/dbraw/zinc/60/18/24/1040601824.db2.gz ZZAYZEOSRTVQAB-JKSUJKDBSA-N 1 1 341.455 4.375 20 5 EIBDMO CC(C)CO[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000539927292 1040898186 /nfs/dbraw/zinc/89/81/86/1040898186.db2.gz MNFMFOBSJVICQY-HNNXBMFYSA-N 1 1 344.411 4.102 20 5 EIBDMO COc1cc(C[N@@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)ccc1[N+](=O)[O-] ZINC000484344654 1041217156 /nfs/dbraw/zinc/21/71/56/1041217156.db2.gz OLIUEPNRQZLTTD-CQSZACIVSA-N 1 1 346.349 4.014 20 5 EIBDMO COc1cc(C[N@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)ccc1[N+](=O)[O-] ZINC000484344654 1041217165 /nfs/dbraw/zinc/21/71/65/1041217165.db2.gz OLIUEPNRQZLTTD-CQSZACIVSA-N 1 1 346.349 4.014 20 5 EIBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000480489923 1041331878 /nfs/dbraw/zinc/33/18/78/1041331878.db2.gz LWOHNDDUCGTCPE-CQSZACIVSA-N 1 1 342.443 4.065 20 5 EIBDMO Cn1cccc1[C@@H]1CCCC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000538725518 1041515660 /nfs/dbraw/zinc/51/56/60/1041515660.db2.gz ZYAXRUDODSWLFB-AIADIJKESA-N 1 1 325.412 4.174 20 5 EIBDMO CC(C)(O)C[N@@H+](Cc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000540521669 1041515960 /nfs/dbraw/zinc/51/59/60/1041515960.db2.gz ZKPCORWJQVQOBZ-UHFFFAOYSA-N 1 1 348.830 4.021 20 5 EIBDMO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@@H](C)c1ccc(F)cc1 ZINC000516618077 1041678076 /nfs/dbraw/zinc/67/80/76/1041678076.db2.gz IIONYPYUUTVTOS-ZDUSSCGKSA-N 1 1 332.375 4.326 20 5 EIBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@@H](C)c1ccc(F)cc1 ZINC000516618077 1041678079 /nfs/dbraw/zinc/67/80/79/1041678079.db2.gz IIONYPYUUTVTOS-ZDUSSCGKSA-N 1 1 332.375 4.326 20 5 EIBDMO C[C@H](CN[C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)C[NH+](C)C ZINC000425944924 1042033723 /nfs/dbraw/zinc/03/37/23/1042033723.db2.gz ZEYJNUSTYKLPDO-ZIAGYGMSSA-N 1 1 347.484 4.172 20 5 EIBDMO C[C@H](C[NH2+][C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)CN(C)C ZINC000425944924 1042033733 /nfs/dbraw/zinc/03/37/33/1042033733.db2.gz ZEYJNUSTYKLPDO-ZIAGYGMSSA-N 1 1 347.484 4.172 20 5 EIBDMO C[N@@H+](CC[C@@H]1CCCO1)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000467366361 1042049453 /nfs/dbraw/zinc/04/94/53/1042049453.db2.gz AFKQZBXVQXMOFD-AWEZNQCLSA-N 1 1 346.452 4.324 20 5 EIBDMO CC(C)[N@@H+](C)CCCNCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000517540953 1042065481 /nfs/dbraw/zinc/06/54/81/1042065481.db2.gz RBLPZPAGDUDATL-UHFFFAOYSA-N 1 1 347.484 4.143 20 5 EIBDMO CCC[C@H]1CCCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000541696411 1042069927 /nfs/dbraw/zinc/06/99/27/1042069927.db2.gz DWIJNQKHSMHHEY-INIZCTEOSA-N 1 1 329.400 4.404 20 5 EIBDMO CCC[C@H]1[C@H](C)CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000464731289 1042135911 /nfs/dbraw/zinc/13/59/11/1042135911.db2.gz GXRHDSPFUVMPHE-CJNGLKHVSA-N 1 1 344.415 4.045 20 5 EIBDMO COc1ccc(C[N@@H+]2C[C@@H](C)C[C@@H]2c2ccccc2F)cc1[N+](=O)[O-] ZINC000464725683 1042141749 /nfs/dbraw/zinc/14/17/49/1042141749.db2.gz ORQVTGADNXZRMC-SUMWQHHRSA-N 1 1 344.386 4.326 20 5 EIBDMO COc1ccc(C[N@H+]2C[C@@H](C)C[C@@H]2c2ccccc2F)cc1[N+](=O)[O-] ZINC000464725683 1042141755 /nfs/dbraw/zinc/14/17/55/1042141755.db2.gz ORQVTGADNXZRMC-SUMWQHHRSA-N 1 1 344.386 4.326 20 5 EIBDMO CC(C)N(C)c1ccccc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000438344634 1042146505 /nfs/dbraw/zinc/14/65/05/1042146505.db2.gz JCYQVRREEZEMGA-UHFFFAOYSA-N 1 1 347.846 4.383 20 5 EIBDMO COc1ccc(C[N@@H+]2CC[C@H](C)C[C@H]2c2ccc(C)o2)cc1[N+](=O)[O-] ZINC000464828895 1042186680 /nfs/dbraw/zinc/18/66/80/1042186680.db2.gz DTKVBISCNPKZIV-BBRMVZONSA-N 1 1 344.411 4.478 20 5 EIBDMO COc1ccc(C[N@H+]2CC[C@H](C)C[C@H]2c2ccc(C)o2)cc1[N+](=O)[O-] ZINC000464828895 1042186683 /nfs/dbraw/zinc/18/66/83/1042186683.db2.gz DTKVBISCNPKZIV-BBRMVZONSA-N 1 1 344.411 4.478 20 5 EIBDMO C[C@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@H](c2ccco2)C1 ZINC000464858280 1042202939 /nfs/dbraw/zinc/20/29/39/1042202939.db2.gz OMBFQHGFHCWWLV-HOCLYGCPSA-N 1 1 330.384 4.040 20 5 EIBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+](C)C2CCC2)cc1OC ZINC000541985975 1042208905 /nfs/dbraw/zinc/20/89/05/1042208905.db2.gz ZHISPBADUTXKLJ-CYBMUJFWSA-N 1 1 336.432 4.013 20 5 EIBDMO CC[NH+](CC)Cc1ccccc1CN[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000073520852 1042210779 /nfs/dbraw/zinc/21/07/79/1042210779.db2.gz CEQDPRPYZUGSFF-MRXNPFEDSA-N 1 1 341.455 4.287 20 5 EIBDMO C[C@@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H](C)C1 ZINC000443647008 1042214784 /nfs/dbraw/zinc/21/47/84/1042214784.db2.gz DCKFXUUDWJZZCP-CABCVRRESA-N 1 1 343.427 4.160 20 5 EIBDMO C[C@@H]1C[C@H]1c1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)o1 ZINC000030153146 1042490658 /nfs/dbraw/zinc/49/06/58/1042490658.db2.gz QHEUAUYDGBOIMK-FZKQIMNGSA-N 1 1 326.396 4.476 20 5 EIBDMO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)o1 ZINC000030153146 1042490670 /nfs/dbraw/zinc/49/06/70/1042490670.db2.gz QHEUAUYDGBOIMK-FZKQIMNGSA-N 1 1 326.396 4.476 20 5 EIBDMO CC(C)([NH2+]Cc1cnc(-c2ccccc2)[nH]1)c1ccccc1[N+](=O)[O-] ZINC000492224632 1042585542 /nfs/dbraw/zinc/58/55/42/1042585542.db2.gz JWQQYXGGGUKWNU-UHFFFAOYSA-N 1 1 336.395 4.010 20 5 EIBDMO C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCS1 ZINC000426390836 1042633269 /nfs/dbraw/zinc/63/32/69/1042633269.db2.gz MBOIWDYIJLKXNX-ZDUSSCGKSA-N 1 1 332.425 4.182 20 5 EIBDMO CCOc1cc(C[NH2+][C@@H](C)c2ccccc2Cl)ccc1[N+](=O)[O-] ZINC000492483416 1042669452 /nfs/dbraw/zinc/66/94/52/1042669452.db2.gz KLDSCJYGLHRGSR-LBPRGKRZSA-N 1 1 334.803 4.498 20 5 EIBDMO CCOc1cc(C[NH2+]C(C)(C)c2nc(C)c(C)s2)ccc1[N+](=O)[O-] ZINC000492722682 1042736267 /nfs/dbraw/zinc/73/62/67/1042736267.db2.gz OITJVVKNQYXKRQ-UHFFFAOYSA-N 1 1 349.456 4.092 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)Cc1nc2ccccc2o1 ZINC000492937016 1042770563 /nfs/dbraw/zinc/77/05/63/1042770563.db2.gz PLXRNAQMYKKKFB-CYBMUJFWSA-N 1 1 325.368 4.237 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)Cc1nc2ccccc2o1 ZINC000492937016 1042770572 /nfs/dbraw/zinc/77/05/72/1042770572.db2.gz PLXRNAQMYKKKFB-CYBMUJFWSA-N 1 1 325.368 4.237 20 5 EIBDMO Cc1ccc(C[N@H+](Cc2cccs2)C[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000506706623 1042792691 /nfs/dbraw/zinc/79/26/91/1042792691.db2.gz LUHCIKBYCTUFGQ-INIZCTEOSA-N 1 1 346.452 4.146 20 5 EIBDMO Cc1ccc(C[N@H+](Cc2cccs2)C[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000506706624 1042792726 /nfs/dbraw/zinc/79/27/26/1042792726.db2.gz LUHCIKBYCTUFGQ-MRXNPFEDSA-N 1 1 346.452 4.146 20 5 EIBDMO CC(C)(C)C[C@@H]1CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000141473092 1042873958 /nfs/dbraw/zinc/87/39/58/1042873958.db2.gz SZGDYIVEQYQRQR-HNNXBMFYSA-N 1 1 344.415 4.045 20 5 EIBDMO CCC[N@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)C[C@@H]1CCCCO1 ZINC000761511674 1042874122 /nfs/dbraw/zinc/87/41/22/1042874122.db2.gz NUQBYDNYODITJH-AWEZNQCLSA-N 1 1 326.824 4.029 20 5 EIBDMO Cc1ccc2c(c1C)OC[C@H]2[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761517613 1042875022 /nfs/dbraw/zinc/87/50/22/1042875022.db2.gz VIMJQZHRKNROBC-OAHLLOKOSA-N 1 1 332.787 4.088 20 5 EIBDMO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000611554145 1043046304 /nfs/dbraw/zinc/04/63/04/1043046304.db2.gz GDKVGHJYGUSMTG-QWHCGFSZSA-N 1 1 346.349 4.027 20 5 EIBDMO CC(C)O[C@H](C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000428251047 1043695682 /nfs/dbraw/zinc/69/56/82/1043695682.db2.gz SPTMAWJPXOXXJZ-HXUWFJFHSA-N 1 1 340.423 4.119 20 5 EIBDMO CC(C)([NH2+]Cc1cncc(C(F)(F)F)c1)c1ccccc1[N+](=O)[O-] ZINC000429236441 1043822754 /nfs/dbraw/zinc/82/27/54/1043822754.db2.gz IKHNNVICPGQSRK-UHFFFAOYSA-N 1 1 339.317 4.034 20 5 EIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000732212949 1043885879 /nfs/dbraw/zinc/88/58/79/1043885879.db2.gz VKYWDZOOGBICPI-ZDUSSCGKSA-N 1 1 334.778 4.377 20 5 EIBDMO C[C@@H]([NH2+]Cc1cccnc1OC1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000173318372 1043890487 /nfs/dbraw/zinc/89/04/87/1043890487.db2.gz NUWOMMNIJYWZSD-CQSZACIVSA-N 1 1 341.411 4.162 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC[C@@H]4CCC[C@H]43)o2)c1 ZINC000245450676 1043899454 /nfs/dbraw/zinc/89/94/54/1043899454.db2.gz OVWDZDQDARQAOM-WMLDXEAASA-N 1 1 341.411 4.057 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccc(-c2c(F)cccc2F)o1 ZINC000115612468 1043964861 /nfs/dbraw/zinc/96/48/61/1043964861.db2.gz AHJOFAZGAJMBOJ-UHFFFAOYSA-N 1 1 344.317 4.423 20 5 EIBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@H]2c2ccc(F)c(F)c2)cc1 ZINC000732989099 1044063327 /nfs/dbraw/zinc/06/33/27/1044063327.db2.gz ODGIDJHNYOSFBU-SFHVURJKSA-N 1 1 348.349 4.089 20 5 EIBDMO Cc1[nH+]c2cc(Nc3ccc([N+](=O)[O-])c(OC(F)F)c3)ccc2n1C ZINC000301950089 1044317848 /nfs/dbraw/zinc/31/78/48/1044317848.db2.gz GKHBPSHUJMSOOT-UHFFFAOYSA-N 1 1 348.309 4.135 20 5 EIBDMO CC[N@@H+](Cc1c[nH]c2ccccc12)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000190489470 1044399417 /nfs/dbraw/zinc/39/94/17/1044399417.db2.gz KXUUBJNKRAMCNH-UHFFFAOYSA-N 1 1 339.395 4.107 20 5 EIBDMO CCc1ccc([C@@H]([NH2+]C[C@@H](OC)C(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543404220 1044525204 /nfs/dbraw/zinc/52/52/04/1044525204.db2.gz YKDJFLYJCSOXTG-MOPGFXCFSA-N 1 1 346.427 4.100 20 5 EIBDMO CCc1ccc([C@@H]([NH2+]C[C@H](OC)C(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543404223 1044525919 /nfs/dbraw/zinc/52/59/19/1044525919.db2.gz YKDJFLYJCSOXTG-OALUTQOASA-N 1 1 346.427 4.100 20 5 EIBDMO C[N@H+]1CCC[C@@H](CNc2sccc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000301998251 1044663171 /nfs/dbraw/zinc/66/31/71/1044663171.db2.gz IFRBMDFWHJLNBH-SMDDNHRTSA-N 1 1 337.470 4.213 20 5 EIBDMO C[N@H+](Cc1ccccc1)CC1CCN(c2sccc2[N+](=O)[O-])CC1 ZINC000301997275 1044666546 /nfs/dbraw/zinc/66/65/46/1044666546.db2.gz QDNYPWQOSDXJHR-UHFFFAOYSA-N 1 1 345.468 4.005 20 5 EIBDMO CCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H]1CCCCO1 ZINC000735493171 1044832602 /nfs/dbraw/zinc/83/26/02/1044832602.db2.gz WVUPMUCMVDSOQD-HNNXBMFYSA-N 1 1 326.824 4.029 20 5 EIBDMO CCC[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H]1CCCCO1 ZINC000735493171 1044832606 /nfs/dbraw/zinc/83/26/06/1044832606.db2.gz WVUPMUCMVDSOQD-HNNXBMFYSA-N 1 1 326.824 4.029 20 5 EIBDMO C[C@H]([NH2+][C@@H](CN(C)C)c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000555226029 1044834652 /nfs/dbraw/zinc/83/46/52/1044834652.db2.gz OPBUFTQMRNSYKT-UGSOOPFHSA-N 1 1 347.846 4.202 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(N[C@H]2C[N@H+](Cc3ccccc3)CC[C@H]2C)c1 ZINC000716233011 1044857473 /nfs/dbraw/zinc/85/74/73/1044857473.db2.gz TYZRNLKQBIXQFC-APWZRJJASA-N 1 1 339.439 4.226 20 5 EIBDMO C[N@@H+](CCc1cccc(Nc2ncc([N+](=O)[O-])cc2Cl)c1)C1CC1 ZINC000302011636 1045153822 /nfs/dbraw/zinc/15/38/22/1045153822.db2.gz YVYXMRVLIWITPP-UHFFFAOYSA-N 1 1 346.818 4.024 20 5 EIBDMO Cc1cccc(NC[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)c1[N+](=O)[O-] ZINC000302490421 1045180442 /nfs/dbraw/zinc/18/04/42/1045180442.db2.gz JVOIPEWWYHTLLN-KBXCAEBGSA-N 1 1 345.468 4.460 20 5 EIBDMO C[C@H](N[C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000556132940 1045253305 /nfs/dbraw/zinc/25/33/05/1045253305.db2.gz UWVFVPMGONKCTR-KNBMTAEXSA-N 1 1 339.439 4.081 20 5 EIBDMO C[C@H]([NH2+][C@H]1CCN(C)[C@H](c2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000556132940 1045253316 /nfs/dbraw/zinc/25/33/16/1045253316.db2.gz UWVFVPMGONKCTR-KNBMTAEXSA-N 1 1 339.439 4.081 20 5 EIBDMO Cc1c([C@@H](C)[NH2+][C@H]2COc3c2cccc3Cl)cccc1[N+](=O)[O-] ZINC000611336859 1045283334 /nfs/dbraw/zinc/28/33/34/1045283334.db2.gz ZZDWSQWWDYJUBB-ABAIWWIYSA-N 1 1 332.787 4.341 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1COc2c1cccc2Cl ZINC000611336822 1045284016 /nfs/dbraw/zinc/28/40/16/1045284016.db2.gz NFCROYSIHGOFHC-ZBEGNZNMSA-N 1 1 332.787 4.341 20 5 EIBDMO Cc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1[N+](=O)[O-] ZINC000768337666 1045793981 /nfs/dbraw/zinc/79/39/81/1045793981.db2.gz JADAOUPEKBJLHJ-UHFFFAOYSA-N 1 1 343.383 4.222 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+](CCC(F)(F)F)CC2CC2)ccc1Cl ZINC000768548589 1045822862 /nfs/dbraw/zinc/82/28/62/1045822862.db2.gz HGYKGCWEXGNFTP-UHFFFAOYSA-N 1 1 336.741 4.413 20 5 EIBDMO C[C@@H]1CCC[N@@H+](CCCCNc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000301121216 1045895404 /nfs/dbraw/zinc/89/54/04/1045895404.db2.gz WZCSVLRDITUBKI-OAHLLOKOSA-N 1 1 342.443 4.067 20 5 EIBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)c(F)c1 ZINC000301131854 1045949562 /nfs/dbraw/zinc/94/95/62/1045949562.db2.gz ZRIVBQSQPUNCQB-ZDUSSCGKSA-N 1 1 349.431 4.120 20 5 EIBDMO CC[N@@H+](Cc1ccccc1)[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170329377 1046003081 /nfs/dbraw/zinc/00/30/81/1046003081.db2.gz PPMBYHAZKQKNES-OAHLLOKOSA-N 1 1 328.412 4.057 20 5 EIBDMO CC(C)([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000792872844 1046087652 /nfs/dbraw/zinc/08/76/52/1046087652.db2.gz PVURTUFVYXOSFO-UHFFFAOYSA-N 1 1 349.774 4.181 20 5 EIBDMO c1ccc2c(c1)cc1ccccc1c2C[N@H+]1CCO[C@@H]([C@H]2CCCO2)C1 ZINC000770303677 1046176995 /nfs/dbraw/zinc/17/69/95/1046176995.db2.gz IPGGPHZVTKCETO-DHIUTWEWSA-N 1 1 347.458 4.373 20 5 EIBDMO CC[C@@H]1CCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000536680624 1046667715 /nfs/dbraw/zinc/66/77/15/1046667715.db2.gz XPASWROXVMKEBO-OAHLLOKOSA-N 1 1 342.443 4.007 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)c1nc2c(s1)CCC2 ZINC000459634166 1046826035 /nfs/dbraw/zinc/82/60/35/1046826035.db2.gz QINNALXVZFCDLO-RYUDHWBXSA-N 1 1 331.441 4.260 20 5 EIBDMO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000459649697 1046835391 /nfs/dbraw/zinc/83/53/91/1046835391.db2.gz LCDWYZXRXBDRPN-LBPRGKRZSA-N 1 1 334.803 4.416 20 5 EIBDMO COc1ccccc1[C@H]1CC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000746671960 1046979984 /nfs/dbraw/zinc/97/99/84/1046979984.db2.gz CTBLYECDGKWXSA-ZDUSSCGKSA-N 1 1 346.814 4.246 20 5 EIBDMO C[C@@H]1C[C@H](c2ccccc2)[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC001170084547 1047184110 /nfs/dbraw/zinc/18/41/10/1047184110.db2.gz BWZIUQKAQXUIBP-DNVCBOLYSA-N 1 1 326.396 4.057 20 5 EIBDMO C[N@@H+](CCCOc1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000788463259 1047194139 /nfs/dbraw/zinc/19/41/39/1047194139.db2.gz GZCUQNVGLHXMFD-UHFFFAOYSA-N 1 1 334.803 4.149 20 5 EIBDMO C[N@H+](CCCOc1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000788463259 1047194132 /nfs/dbraw/zinc/19/41/32/1047194132.db2.gz GZCUQNVGLHXMFD-UHFFFAOYSA-N 1 1 334.803 4.149 20 5 EIBDMO C[C@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788481041 1047197668 /nfs/dbraw/zinc/19/76/68/1047197668.db2.gz OZRFBGAUOQMYPC-WFASDCNBSA-N 1 1 332.350 4.251 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3ccc(Cl)nc3)C2)cc1 ZINC000824820805 1047963715 /nfs/dbraw/zinc/96/37/15/1047963715.db2.gz NNLUYPFPZGTBFV-OAHLLOKOSA-N 1 1 331.803 4.023 20 5 EIBDMO CC(C)(CO)[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 ZINC000809655578 1048455460 /nfs/dbraw/zinc/45/54/60/1048455460.db2.gz MNBWZLIYMIPLFB-QGZVFWFLSA-N 1 1 348.830 4.098 20 5 EIBDMO CCC[N@@H+](CCc1ccccn1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000809734519 1048483568 /nfs/dbraw/zinc/48/35/68/1048483568.db2.gz JBKXPSHCNNLCDF-UHFFFAOYSA-N 1 1 333.819 4.098 20 5 EIBDMO C[C@@H]([NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1nc2ccccc2s1 ZINC000815580137 1048521201 /nfs/dbraw/zinc/52/12/01/1048521201.db2.gz CQMHXYITDHWJMP-GHMZBOCLSA-N 1 1 342.424 4.199 20 5 EIBDMO CC[C@H](O)[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809948108 1048578586 /nfs/dbraw/zinc/57/85/86/1048578586.db2.gz UGJLFPQHPADDIN-KBPBESRZSA-N 1 1 347.242 4.027 20 5 EIBDMO CC[C@H](O)[C@@H]1CCCC[N@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809948108 1048578602 /nfs/dbraw/zinc/57/86/02/1048578602.db2.gz UGJLFPQHPADDIN-KBPBESRZSA-N 1 1 347.242 4.027 20 5 EIBDMO Cc1csc([C@H]2CCC[N@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000195328863 1048653716 /nfs/dbraw/zinc/65/37/16/1048653716.db2.gz VPQOIYZFELTWJW-ZFWWWQNUSA-N 1 1 331.441 4.300 20 5 EIBDMO Cc1cc(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])cc(C)n1 ZINC000817409452 1048963335 /nfs/dbraw/zinc/96/33/35/1048963335.db2.gz CBIRBRDVRHDXPN-UHFFFAOYSA-N 1 1 340.210 4.203 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000609541273 1049142982 /nfs/dbraw/zinc/14/29/82/1049142982.db2.gz BMONSHQMTKJBJW-CYBMUJFWSA-N 1 1 334.778 4.377 20 5 EIBDMO Cc1c(C[N@H+]2CCS[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000609800593 1049328168 /nfs/dbraw/zinc/32/81/68/1049328168.db2.gz PGBBGMSCEXHMAH-GOSISDBHSA-N 1 1 328.437 4.193 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCS[C@H](c2ccccc2)C1 ZINC000609800897 1049330850 /nfs/dbraw/zinc/33/08/50/1049330850.db2.gz UZZSBOUPVDHUGD-KRWDZBQOSA-N 1 1 332.400 4.024 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCS[C@H](c2ccccc2)C1 ZINC000609800897 1049330865 /nfs/dbraw/zinc/33/08/65/1049330865.db2.gz UZZSBOUPVDHUGD-KRWDZBQOSA-N 1 1 332.400 4.024 20 5 EIBDMO COc1ccc(C[N@H+]2C[C@H](c3ccc(F)cc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000609916147 1049397197 /nfs/dbraw/zinc/39/71/97/1049397197.db2.gz AHUVLXNLCDYKHP-XJKSGUPXSA-N 1 1 344.386 4.121 20 5 EIBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000805749732 1049517019 /nfs/dbraw/zinc/51/70/19/1049517019.db2.gz QZAATMJFDDWHNN-PXAZEXFGSA-N 1 1 331.803 4.226 20 5 EIBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000805749732 1049517035 /nfs/dbraw/zinc/51/70/35/1049517035.db2.gz QZAATMJFDDWHNN-PXAZEXFGSA-N 1 1 331.803 4.226 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC=C(c2ccc(Cl)nc2)CC1 ZINC000773654244 1050201228 /nfs/dbraw/zinc/20/12/28/1050201228.db2.gz DCMCQBSPENWALG-ZDUSSCGKSA-N 1 1 343.814 4.494 20 5 EIBDMO C[N@@H+](CCc1ccc(F)cc1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914837 1050232336 /nfs/dbraw/zinc/23/23/36/1050232336.db2.gz JYFMYKMISSBPHI-IBGZPJMESA-N 1 1 342.414 4.156 20 5 EIBDMO CCC[N@@H+]([C@H](C)CC)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173184196 1050338134 /nfs/dbraw/zinc/33/81/34/1050338134.db2.gz LWMPVTJAJRFYLD-OLZOCXBDSA-N 1 1 326.412 4.184 20 5 EIBDMO CCCC[N@@H+](CCC)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173188506 1050338349 /nfs/dbraw/zinc/33/83/49/1050338349.db2.gz GCFIWXQMUQMWHQ-CYBMUJFWSA-N 1 1 326.412 4.186 20 5 EIBDMO COc1ccc([C@@H]2CC[N@H+]([C@@H](C)Cc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC001173230755 1050359379 /nfs/dbraw/zinc/35/93/79/1050359379.db2.gz FLLMWHYCTNXUBO-MAUKXSAKSA-N 1 1 340.423 4.024 20 5 EIBDMO CC(C)c1nc(C[N@@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)cs1 ZINC001173231718 1050359836 /nfs/dbraw/zinc/35/98/36/1050359836.db2.gz CMJXSMYNYKDQED-CYBMUJFWSA-N 1 1 333.457 4.238 20 5 EIBDMO CC(C)c1nc(C[N@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)cs1 ZINC001173231718 1050359823 /nfs/dbraw/zinc/35/98/23/1050359823.db2.gz CMJXSMYNYKDQED-CYBMUJFWSA-N 1 1 333.457 4.238 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2cccc(Cl)c2C1 ZINC001173231488 1050359865 /nfs/dbraw/zinc/35/98/65/1050359865.db2.gz LNKWWTMHWIJZFY-CYBMUJFWSA-N 1 1 330.815 4.238 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2cc(Cl)ccc2C1 ZINC001173234232 1050362984 /nfs/dbraw/zinc/36/29/84/1050362984.db2.gz QGPTUCLOBZDTOO-CYBMUJFWSA-N 1 1 330.815 4.238 20 5 EIBDMO C[C@@H](c1ccccc1)[NH+]1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC001187462627 1050544462 /nfs/dbraw/zinc/54/44/62/1050544462.db2.gz DSBPKIOAUOCEIS-AWEZNQCLSA-N 1 1 345.830 4.131 20 5 EIBDMO C[C@@H]1Cc2cc(C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C3CC3)ccc2O1 ZINC001179909033 1050832152 /nfs/dbraw/zinc/83/21/52/1050832152.db2.gz AVKMODGXMUKDQD-CQSZACIVSA-N 1 1 338.407 4.083 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@@H](COc2ccccc2)C1 ZINC001180318058 1050951208 /nfs/dbraw/zinc/95/12/08/1050951208.db2.gz VNMPHBGSRLGRTL-QGZVFWFLSA-N 1 1 340.423 4.113 20 5 EIBDMO CC[C@@H]1CC[C@@H](C)[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC001174622525 1051088755 /nfs/dbraw/zinc/08/87/55/1051088755.db2.gz KUVUOVSECUBYGX-ZIAGYGMSSA-N 1 1 329.400 4.260 20 5 EIBDMO CCC[N@@H+](Cc1cc([O-])ccc1[N+](=O)[O-])[C@@H]1CCc2ccccc21 ZINC001190570779 1051218048 /nfs/dbraw/zinc/21/80/48/1051218048.db2.gz JMOHZHHTMRPXJC-LJQANCHMSA-N 1 1 326.396 4.200 20 5 EIBDMO C[C@H]1CCC[C@H](C)[NH+]1Cc1cc([N+](=O)[O-])ccc1Br ZINC001190865495 1051296143 /nfs/dbraw/zinc/29/61/43/1051296143.db2.gz VSWXVCPVYOSEJX-QWRGUYRKSA-N 1 1 327.222 4.120 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H](C)C[C@H]1c1cccc(F)c1 ZINC001191244099 1051409705 /nfs/dbraw/zinc/40/97/05/1051409705.db2.gz GMWNQUJETVYDFE-UGSOOPFHSA-N 1 1 344.386 4.326 20 5 EIBDMO CCC[N@@H+](Cc1ccc(OC)cc1)Cc1ccc([N+](=O)[O-])cc1OC ZINC001175322804 1051530634 /nfs/dbraw/zinc/53/06/34/1051530634.db2.gz GRFRMRXCCVLYHK-UHFFFAOYSA-N 1 1 344.411 4.024 20 5 EIBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)C1(CC)CC ZINC001191822682 1051563201 /nfs/dbraw/zinc/56/32/01/1051563201.db2.gz YAYIOGAYBOULTI-IAGOWNOFSA-N 1 1 338.423 4.150 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC001192626778 1051783100 /nfs/dbraw/zinc/78/31/00/1051783100.db2.gz OUGULMBNDQMUDY-NSHDSACASA-N 1 1 349.774 4.316 20 5 EIBDMO CCOc1cc(C[N@@H+]2CCc3ccsc3[C@@H]2C)ccc1[N+](=O)[O-] ZINC001175830941 1051795567 /nfs/dbraw/zinc/79/55/67/1051795567.db2.gz LQPHWVBQHNVPDT-LBPRGKRZSA-N 1 1 332.425 4.174 20 5 EIBDMO CCOc1cc(C[N@H+]2CCc3ccsc3[C@@H]2C)ccc1[N+](=O)[O-] ZINC001175830941 1051795584 /nfs/dbraw/zinc/79/55/84/1051795584.db2.gz LQPHWVBQHNVPDT-LBPRGKRZSA-N 1 1 332.425 4.174 20 5 EIBDMO C[C@H]1C[N@@H+](Cc2c3ccccc3cc3ccccc32)CC[S@](=O)C1 ZINC000763651397 1051812277 /nfs/dbraw/zinc/81/22/77/1051812277.db2.gz ICGHBXJWXPOZNN-FYSMJZIKSA-N 1 1 337.488 4.193 20 5 EIBDMO C[C@@H]1CC[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)[C@@H]1c1ccccc1 ZINC001176035791 1051881164 /nfs/dbraw/zinc/88/11/64/1051881164.db2.gz CUVIIQFBRXUUPT-XIKOKIGWSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@@H]1CC[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)[C@@H]1c1ccccc1 ZINC001176035791 1051881171 /nfs/dbraw/zinc/88/11/71/1051881171.db2.gz CUVIIQFBRXUUPT-XIKOKIGWSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@H]1CC[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)[C@H]1c1ccccc1 ZINC001176035788 1051881240 /nfs/dbraw/zinc/88/12/40/1051881240.db2.gz CUVIIQFBRXUUPT-KPZWWZAWSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@H]1CC[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)[C@H]1c1ccccc1 ZINC001176035788 1051881242 /nfs/dbraw/zinc/88/12/42/1051881242.db2.gz CUVIIQFBRXUUPT-KPZWWZAWSA-N 1 1 332.350 4.456 20 5 EIBDMO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]2C ZINC001193271979 1051893951 /nfs/dbraw/zinc/89/39/51/1051893951.db2.gz CZQROORCQNJRSQ-ZIAGYGMSSA-N 1 1 326.396 4.111 20 5 EIBDMO COc1ccc2c(c1)C[C@@H](C)[N@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]2C ZINC001193271979 1051893953 /nfs/dbraw/zinc/89/39/53/1051893953.db2.gz CZQROORCQNJRSQ-ZIAGYGMSSA-N 1 1 326.396 4.111 20 5 EIBDMO CO[C@@H](C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC001193744127 1051980204 /nfs/dbraw/zinc/98/02/04/1051980204.db2.gz ZUWCPKDKNCPXNW-SFHVURJKSA-N 1 1 348.830 4.110 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1[C@@H](C)c1ccccc1 ZINC001176366165 1052041487 /nfs/dbraw/zinc/04/14/87/1052041487.db2.gz XYWLHSQOKKSYBX-KXBFYZLASA-N 1 1 340.423 4.372 20 5 EIBDMO CCCC[N@H+]1CCCC[C@H]1CNc1ccc(Cl)cc1[N+](=O)[O-] ZINC001185099049 1052167020 /nfs/dbraw/zinc/16/70/20/1052167020.db2.gz WJVIHGHMGAKBSL-AWEZNQCLSA-N 1 1 325.840 4.315 20 5 EIBDMO CC[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC)c1ccccc1OC ZINC000850423005 1053195631 /nfs/dbraw/zinc/19/56/31/1053195631.db2.gz KRUYSHCPNFDUSR-DYVFJYSZSA-N 1 1 344.411 4.414 20 5 EIBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@@H]1CCC[C@H]1c1ccccc1 ZINC001195022853 1053229429 /nfs/dbraw/zinc/22/94/29/1053229429.db2.gz OSSXOIYDHYKVFU-ZWKOTPCHSA-N 1 1 340.423 4.242 20 5 EIBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@@H]1CCC[C@@H]1c1ccccc1 ZINC001195022851 1053230048 /nfs/dbraw/zinc/23/00/48/1053230048.db2.gz OSSXOIYDHYKVFU-QZTJIDSGSA-N 1 1 340.423 4.242 20 5 EIBDMO C[C@]1(Cc2ccccc2F)CCC[N@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001195464660 1053399478 /nfs/dbraw/zinc/39/94/78/1053399478.db2.gz XZJQCZNPBRCSLG-LJQANCHMSA-N 1 1 346.377 4.470 20 5 EIBDMO CC1(C)CC(C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)C1 ZINC001195546442 1053432495 /nfs/dbraw/zinc/43/24/95/1053432495.db2.gz COYCNFCOJPZXKM-IYARVYRRSA-N 1 1 346.471 4.137 20 5 EIBDMO COc1ccc(C[C@@H]2CCCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)cc1 ZINC001195874272 1053512612 /nfs/dbraw/zinc/51/26/12/1053512612.db2.gz RPFWQULICOXIJJ-SFHVURJKSA-N 1 1 340.423 4.201 20 5 EIBDMO Cc1cccc([C@@H]2CCC[N@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)c1C ZINC000776582766 1053562126 /nfs/dbraw/zinc/56/21/26/1053562126.db2.gz BUIPVLGNLWJTQM-PMACEKPBSA-N 1 1 340.423 4.082 20 5 EIBDMO CCCC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H](C)c1ccc(C)o1 ZINC000776579596 1053564315 /nfs/dbraw/zinc/56/43/15/1053564315.db2.gz NZKHNCYLYJXMTK-CRAIPNDOSA-N 1 1 346.427 4.393 20 5 EIBDMO COCC[C@@H](c1ccccc1)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000765499011 1053576145 /nfs/dbraw/zinc/57/61/45/1053576145.db2.gz FNJOUITXPJCTOZ-SFHVURJKSA-N 1 1 348.830 4.458 20 5 EIBDMO COCC[C@@H](c1ccccc1)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000765499011 1053576161 /nfs/dbraw/zinc/57/61/61/1053576161.db2.gz FNJOUITXPJCTOZ-SFHVURJKSA-N 1 1 348.830 4.458 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@H](C4CCC4)C3)co2)cc1 ZINC001196255292 1053618299 /nfs/dbraw/zinc/61/82/99/1053618299.db2.gz TZIFYFIYHHUFOS-INIZCTEOSA-N 1 1 341.411 4.262 20 5 EIBDMO COc1cc(C[N@H+]2CCCC[C@H]2CC2CCC2)c([N+](=O)[O-])cc1F ZINC001196328885 1053640618 /nfs/dbraw/zinc/64/06/18/1053640618.db2.gz JITDNXNTTYVIOT-HNNXBMFYSA-N 1 1 336.407 4.287 20 5 EIBDMO Cc1ccc(C[NH2+][C@@H](c2ncc[nH]2)C2CCCCC2)cc1[N+](=O)[O-] ZINC000866539801 1053776108 /nfs/dbraw/zinc/77/61/08/1053776108.db2.gz GZQRMPXCUDFJFN-QGZVFWFLSA-N 1 1 328.416 4.038 20 5 EIBDMO Cc1[nH+]c2cc(Nc3ccc([N+](=O)[O-])c4cnccc34)ccc2n1C ZINC000301419839 1053873011 /nfs/dbraw/zinc/87/30/11/1053873011.db2.gz DLNWBKIYMWOCIM-UHFFFAOYSA-N 1 1 333.351 4.082 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2cc(F)cc(Cl)c2)c1 ZINC000776801613 1053896648 /nfs/dbraw/zinc/89/66/48/1053896648.db2.gz XBGGVZPRPBCTHR-UHFFFAOYSA-N 1 1 329.158 4.331 20 5 EIBDMO C[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])cc2)[C@H]1c1cccs1 ZINC000301428398 1053922327 /nfs/dbraw/zinc/92/23/27/1053922327.db2.gz PSGMHJWUWKUZMX-GUYCJALGSA-N 1 1 331.441 4.151 20 5 EIBDMO CCOCc1ccccc1C[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872021236 1054333912 /nfs/dbraw/zinc/33/39/12/1054333912.db2.gz PDZHQIMAXZIFBO-CYBMUJFWSA-N 1 1 332.375 4.121 20 5 EIBDMO CCOCc1ccc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872022791 1054339142 /nfs/dbraw/zinc/33/91/42/1054339142.db2.gz ZVRXEJBQUKVYHO-CYBMUJFWSA-N 1 1 332.375 4.121 20 5 EIBDMO C[C@H]([NH2+][C@@H]1CCCOc2ccccc21)c1c(F)cccc1[N+](=O)[O-] ZINC000872031291 1054345925 /nfs/dbraw/zinc/34/59/25/1054345925.db2.gz NWNDPBTXKPYPIZ-SWLSCSKDSA-N 1 1 330.359 4.298 20 5 EIBDMO Cc1cccnc1[C@@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])C(C)C ZINC000872034136 1054349993 /nfs/dbraw/zinc/34/99/93/1054349993.db2.gz IBBVMSWCNKLNDD-GUYCJALGSA-N 1 1 331.391 4.485 20 5 EIBDMO Cc1csc([C@H]2CC[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)n1 ZINC000877813039 1055125538 /nfs/dbraw/zinc/12/55/38/1055125538.db2.gz INRUETUTOLNKHJ-NSHDSACASA-N 1 1 337.832 4.003 20 5 EIBDMO CCC[C@@H](C)[C@H]1CCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878199477 1055204958 /nfs/dbraw/zinc/20/49/58/1055204958.db2.gz AZFIDPDXQGZACE-UKRRQHHQSA-N 1 1 344.415 4.045 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cn2cc(Cl)ccc2n1 ZINC000131569599 1055434277 /nfs/dbraw/zinc/43/42/77/1055434277.db2.gz YIQNZBSPOVZQGE-GFCCVEGCSA-N 1 1 344.802 4.055 20 5 EIBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273252900 1055564975 /nfs/dbraw/zinc/56/49/75/1055564975.db2.gz AJALDVBIYHJLNO-MOPGFXCFSA-N 1 1 344.386 4.086 20 5 EIBDMO Cc1cc([NH+]2CCCC2)ccc1NCc1cccc([N+](=O)[O-])c1C ZINC000742258265 1058559090 /nfs/dbraw/zinc/55/90/90/1058559090.db2.gz ZLXQKAHMWZXMEW-UHFFFAOYSA-N 1 1 325.412 4.424 20 5 EIBDMO Cc1[nH+]c2cc(Nc3nc4ccc([N+](=O)[O-])cc4s3)ccc2n1C ZINC000742429976 1058626681 /nfs/dbraw/zinc/62/66/81/1058626681.db2.gz LDZUAUUKCBSVSA-UHFFFAOYSA-N 1 1 339.380 4.143 20 5 EIBDMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000533289467 1032606890 /nfs/dbraw/zinc/60/68/90/1032606890.db2.gz LOZVYPZBSQJYEB-CJNGLKHVSA-N 1 1 344.415 4.045 20 5 EIBDMO O=[N+]([O-])c1ccc(OC(F)F)c(CNc2cccc(C3CC3)[nH+]2)c1 ZINC000339430131 1018872093 /nfs/dbraw/zinc/87/20/93/1018872093.db2.gz QEWDDPMHMAOHBC-UHFFFAOYSA-N 1 1 335.310 4.081 20 5 EIBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1cccc2ccccc21 ZINC001167050290 1018873217 /nfs/dbraw/zinc/87/32/17/1018873217.db2.gz WXYDWQANGHGLLN-UHFFFAOYSA-N 1 1 336.391 4.259 20 5 EIBDMO COc1ccc(C[N@H+]2CC[C@H](c3ccccc3)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000610216032 1019386239 /nfs/dbraw/zinc/38/62/39/1019386239.db2.gz DVUGPMRKZXBFST-QAPCUYQASA-N 1 1 340.423 4.229 20 5 EIBDMO COc1ccc(C[N@H+]2CC[C@@H](c3ccccc3)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000610216031 1019386986 /nfs/dbraw/zinc/38/69/86/1019386986.db2.gz DVUGPMRKZXBFST-MAUKXSAKSA-N 1 1 340.423 4.229 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CC=C(c2c[nH]c3ccccc23)CC1 ZINC000219618707 1019952013 /nfs/dbraw/zinc/95/20/13/1019952013.db2.gz ICFLSLAATMCJRJ-UHFFFAOYSA-N 1 1 333.391 4.365 20 5 EIBDMO CCC[N@H+](Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])CC1CCCCC1 ZINC001167146899 1020378688 /nfs/dbraw/zinc/37/86/88/1020378688.db2.gz QRWLMHFQINAGLH-UHFFFAOYSA-N 1 1 348.443 4.174 20 5 EIBDMO CCC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(F)cc1 ZINC001167237484 1020639802 /nfs/dbraw/zinc/63/98/02/1020639802.db2.gz HZLMCPIYLBEHDE-UHFFFAOYSA-N 1 1 332.375 4.025 20 5 EIBDMO Cc1c(C[N@H+]2CCC[C@@H]2C[C@H](O)c2cccs2)cccc1[N+](=O)[O-] ZINC000175830560 1021082091 /nfs/dbraw/zinc/08/20/91/1021082091.db2.gz ZENHYIIHRXKSBV-WBVHZDCISA-N 1 1 346.452 4.053 20 5 EIBDMO CC[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)[C@@H](C)C(C)C ZINC000706425738 1021547246 /nfs/dbraw/zinc/54/72/46/1021547246.db2.gz RAHLFXFYPQQSJL-NSHDSACASA-N 1 1 329.238 4.224 20 5 EIBDMO CC1(C)CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000536362239 1021843420 /nfs/dbraw/zinc/84/34/20/1021843420.db2.gz FJRDJUFNJJFLJQ-UHFFFAOYSA-N 1 1 329.400 4.262 20 5 EIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc(C(C)(C)C)s1 ZINC000517579340 1022034544 /nfs/dbraw/zinc/03/45/44/1022034544.db2.gz NVYVGWLTJLIZLC-UHFFFAOYSA-N 1 1 333.457 4.023 20 5 EIBDMO C[C@@H]1CCCC[C@H]1[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104666743 1022672594 /nfs/dbraw/zinc/67/25/94/1022672594.db2.gz VIGYAQRAMWPCCT-RHSMWYFYSA-N 1 1 343.427 4.303 20 5 EIBDMO CC[C@@H]1CCCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104661195 1022674586 /nfs/dbraw/zinc/67/45/86/1022674586.db2.gz YCHBCWHLAZOUGT-OAHLLOKOSA-N 1 1 329.400 4.057 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC2(CCOCC2)[C@@H]1C(C)C ZINC000414523135 1023247712 /nfs/dbraw/zinc/24/77/12/1023247712.db2.gz CVHQFVPASMIICB-QMDZLVRISA-N 1 1 344.455 4.135 20 5 EIBDMO COCCc1cc[nH+]c(N[C@H]2CCCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000417319239 1023263090 /nfs/dbraw/zinc/26/30/90/1023263090.db2.gz BKRUPEBEARXIMR-SFHVURJKSA-N 1 1 341.411 4.058 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](COCc2ccccc2)C1 ZINC000075865022 1023454435 /nfs/dbraw/zinc/45/44/35/1023454435.db2.gz GCAUREKPPQTOEH-WMZOPIPTSA-N 1 1 340.423 4.195 20 5 EIBDMO C[C@@]1([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CCOc2ccccc21 ZINC000933372658 1023596022 /nfs/dbraw/zinc/59/60/22/1023596022.db2.gz VOHRAVDIRIIIDU-QGZVFWFLSA-N 1 1 332.787 4.036 20 5 EIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC3(CCCC3)C2)c1 ZINC001167487325 1023825745 /nfs/dbraw/zinc/82/57/45/1023825745.db2.gz KBFBLIHDPZMRNX-UHFFFAOYSA-N 1 1 328.334 4.380 20 5 EIBDMO Cc1nn(C(C)C)c(C)c1C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000891624471 1023834727 /nfs/dbraw/zinc/83/47/27/1023834727.db2.gz ZDCUSAQSYHWVRI-UHFFFAOYSA-N 1 1 342.443 4.154 20 5 EIBDMO Cc1nn(C(C)C)c(C)c1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000891624471 1023834729 /nfs/dbraw/zinc/83/47/29/1023834729.db2.gz ZDCUSAQSYHWVRI-UHFFFAOYSA-N 1 1 342.443 4.154 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCCCC[C@@H]3c3ccco3)nc2c1 ZINC000610582197 1024119737 /nfs/dbraw/zinc/11/97/37/1024119737.db2.gz WXOPTFGZDJSJKJ-OAHLLOKOSA-N 1 1 341.367 4.446 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCCCC[C@@H]3c3ccco3)nc2c1 ZINC000610582197 1024119757 /nfs/dbraw/zinc/11/97/57/1024119757.db2.gz WXOPTFGZDJSJKJ-OAHLLOKOSA-N 1 1 341.367 4.446 20 5 EIBDMO COc1ccccc1[C@@H]1CC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000093593083 1024624187 /nfs/dbraw/zinc/62/41/87/1024624187.db2.gz JZJKMCMWQSOMSE-DBWMJRBXSA-N 1 1 338.407 4.106 20 5 EIBDMO C[C@H]([NH2+]Cc1ccccc1Br)c1ccc([N+](=O)[O-])cc1 ZINC000048819872 1024737902 /nfs/dbraw/zinc/73/79/02/1024737902.db2.gz AMNLMOBGYGUPAR-NSHDSACASA-N 1 1 335.201 4.208 20 5 EIBDMO Cc1ccc(N2CCC(Nc3c(Cl)cccc3[N+](=O)[O-])CC2)[nH+]c1 ZINC000432322261 1025376850 /nfs/dbraw/zinc/37/68/50/1025376850.db2.gz ACHHEQIAWRJFJQ-UHFFFAOYSA-N 1 1 346.818 4.033 20 5 EIBDMO C[C@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC001167503941 1025457121 /nfs/dbraw/zinc/45/71/21/1025457121.db2.gz GKZWXHZCIQLKNX-SGTLLEGYSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC001167503941 1025457131 /nfs/dbraw/zinc/45/71/31/1025457131.db2.gz GKZWXHZCIQLKNX-SGTLLEGYSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC001167503939 1025457772 /nfs/dbraw/zinc/45/77/72/1025457772.db2.gz GKZWXHZCIQLKNX-KPZWWZAWSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC001167503939 1025457783 /nfs/dbraw/zinc/45/77/83/1025457783.db2.gz GKZWXHZCIQLKNX-KPZWWZAWSA-N 1 1 332.350 4.456 20 5 EIBDMO CCn1nc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c2ccccc21 ZINC000472037940 1025466705 /nfs/dbraw/zinc/46/67/05/1025466705.db2.gz KZWPOWROWPPWIY-CQSZACIVSA-N 1 1 338.411 4.124 20 5 EIBDMO COc1cc(C[N@@H+]2CCC[C@H]2c2cccs2)c([N+](=O)[O-])cc1F ZINC000184225756 1026235170 /nfs/dbraw/zinc/23/51/70/1026235170.db2.gz TVQXFMNCXWNSRI-ZDUSSCGKSA-N 1 1 336.388 4.141 20 5 EIBDMO COc1cc(C[N@H+]2CCC[C@H]2c2cccs2)c([N+](=O)[O-])cc1F ZINC000184225756 1026235181 /nfs/dbraw/zinc/23/51/81/1026235181.db2.gz TVQXFMNCXWNSRI-ZDUSSCGKSA-N 1 1 336.388 4.141 20 5 EIBDMO CC[N@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])[C@H](C)c1cccc(O)c1 ZINC000184231257 1026237112 /nfs/dbraw/zinc/23/71/12/1026237112.db2.gz GPSJMDATPGYVMT-GFCCVEGCSA-N 1 1 348.374 4.031 20 5 EIBDMO CC[N@@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])[C@H](C)c1cccc(O)c1 ZINC000184231257 1026237126 /nfs/dbraw/zinc/23/71/26/1026237126.db2.gz GPSJMDATPGYVMT-GFCCVEGCSA-N 1 1 348.374 4.031 20 5 EIBDMO COc1cc(C[NH2+][C@H](C)c2ccccc2Cl)c([N+](=O)[O-])cc1F ZINC000184239330 1026249721 /nfs/dbraw/zinc/24/97/21/1026249721.db2.gz KKPPURTUWBVHAL-SNVBAGLBSA-N 1 1 338.766 4.247 20 5 EIBDMO CC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCOC(C)(C)C1 ZINC000519569813 1026372361 /nfs/dbraw/zinc/37/23/61/1026372361.db2.gz WPPIZPLEQADCMG-AWEZNQCLSA-N 1 1 326.824 4.028 20 5 EIBDMO COc1cc(C[N@@H+]([C@@H](C)c2ccccc2)C2CC2)ccc1[N+](=O)[O-] ZINC000512241550 1026565940 /nfs/dbraw/zinc/56/59/40/1026565940.db2.gz HCGALVVXPGMYOH-AWEZNQCLSA-N 1 1 326.396 4.329 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCSC3(CCCCC3)C2)c1 ZINC001167610143 1027231467 /nfs/dbraw/zinc/23/14/67/1027231467.db2.gz ZXEORYLRKDWRHB-UHFFFAOYSA-N 1 1 340.876 4.500 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCSC3(CCCCC3)C2)c1 ZINC001167610143 1027231481 /nfs/dbraw/zinc/23/14/81/1027231481.db2.gz ZXEORYLRKDWRHB-UHFFFAOYSA-N 1 1 340.876 4.500 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+]([C@@H]1CCc3cc(Cl)ccc31)CC2 ZINC001167646594 1027828731 /nfs/dbraw/zinc/82/87/31/1027828731.db2.gz FWGBJDYECPEUTF-GOSISDBHSA-N 1 1 328.799 4.294 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+]([C@@H]1CCc3cc(Cl)ccc31)CC2 ZINC001167646594 1027828736 /nfs/dbraw/zinc/82/87/36/1027828736.db2.gz FWGBJDYECPEUTF-GOSISDBHSA-N 1 1 328.799 4.294 20 5 EIBDMO CC[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000444660189 1027933650 /nfs/dbraw/zinc/93/36/50/1027933650.db2.gz IXAQDPWKZIFWKZ-CZUORRHYSA-N 1 1 344.415 4.045 20 5 EIBDMO CC[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H]1CCCC[C@@H]1C ZINC000444666397 1027948938 /nfs/dbraw/zinc/94/89/38/1027948938.db2.gz SHUNGKQTCMAHEO-BBRMVZONSA-N 1 1 344.415 4.045 20 5 EIBDMO C/C(=C/c1ccccc1)C[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444708393 1027999681 /nfs/dbraw/zinc/99/96/81/1027999681.db2.gz QOHYQULYFQTSRW-UVTDQMKNSA-N 1 1 336.395 4.006 20 5 EIBDMO C/C(=C/c1ccccc1)C[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444708393 1027999697 /nfs/dbraw/zinc/99/96/97/1027999697.db2.gz QOHYQULYFQTSRW-UVTDQMKNSA-N 1 1 336.395 4.006 20 5 EIBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2csc([N+](=O)[O-])c2)C12CCCCC2 ZINC000525126729 1029466517 /nfs/dbraw/zinc/46/65/17/1029466517.db2.gz LHFNUHIWYVMVNG-HUUCEWRRSA-N 1 1 338.473 4.216 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCCC34CCC4)cs2)c1 ZINC000446852400 1029603185 /nfs/dbraw/zinc/60/31/85/1029603185.db2.gz JEXPCFIXMOUBAB-UHFFFAOYSA-N 1 1 329.425 4.237 20 5 EIBDMO CC(C)C[C@H]1CCCCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000525410857 1029624426 /nfs/dbraw/zinc/62/44/26/1029624426.db2.gz MLYNIZQWPVEFCI-QGZVFWFLSA-N 1 1 348.443 4.252 20 5 EIBDMO CC(C)[N@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)CC1CCC1 ZINC000446927026 1029642287 /nfs/dbraw/zinc/64/22/87/1029642287.db2.gz DDXVDVYTLWXSDD-UHFFFAOYSA-N 1 1 342.443 4.006 20 5 EIBDMO COc1ccc2c(c1)CCC[N@@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000525786608 1030019441 /nfs/dbraw/zinc/01/94/41/1030019441.db2.gz JMQZNZZAVKCTRU-AWEZNQCLSA-N 1 1 326.396 4.113 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@@H]1COc3ccc(Cl)cc31)CCC2 ZINC000447583421 1030181744 /nfs/dbraw/zinc/18/17/44/1030181744.db2.gz BKFHWZOWKSZZPQ-DLBZAZTESA-N 1 1 344.798 4.349 20 5 EIBDMO CC(C)(C)c1cnc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000447943189 1030430482 /nfs/dbraw/zinc/43/04/82/1030430482.db2.gz OUQOZAUMMGQYIO-UHFFFAOYSA-N 1 1 333.457 4.374 20 5 EIBDMO COc1cc(C[N@@H+](Cc2ccco2)C2CCCC2)ccc1[N+](=O)[O-] ZINC000485741186 1030886893 /nfs/dbraw/zinc/88/68/93/1030886893.db2.gz BMWLMZZUILCQGL-UHFFFAOYSA-N 1 1 330.384 4.141 20 5 EIBDMO Cc1nn(C(C)C)cc1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449496043 1031804868 /nfs/dbraw/zinc/80/48/68/1031804868.db2.gz FYEMQBHNBCEGAO-KRWDZBQOSA-N 1 1 342.443 4.060 20 5 EIBDMO C[C@@H]([NH2+][C@@H]1CCc2cc(F)c(F)c(F)c21)c1ccc([N+](=O)[O-])cc1 ZINC000453337348 1031862774 /nfs/dbraw/zinc/86/27/74/1031862774.db2.gz JRTUKGFSVLOVCL-YMTOWFKASA-N 1 1 336.313 4.350 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3ccco3)o2)c(Cl)c1 ZINC000237816569 1031981652 /nfs/dbraw/zinc/98/16/52/1031981652.db2.gz WSZTVNDJDFOLMF-UHFFFAOYSA-N 1 1 332.743 4.391 20 5 EIBDMO COc1cc(C[N@H+](C)Cc2ccc(F)c(Cl)c2)ccc1[N+](=O)[O-] ZINC000433248670 1034098527 /nfs/dbraw/zinc/09/85/27/1034098527.db2.gz TUZWARZTEHKXAS-UHFFFAOYSA-N 1 1 338.766 4.028 20 5 EIBDMO COc1cc(C[N@@H+](C)Cc2ccc(F)c(Cl)c2)ccc1[N+](=O)[O-] ZINC000433248670 1034098552 /nfs/dbraw/zinc/09/85/52/1034098552.db2.gz TUZWARZTEHKXAS-UHFFFAOYSA-N 1 1 338.766 4.028 20 5 EIBDMO Cc1noc(C)c1C(C)(C)[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000513099726 1034578804 /nfs/dbraw/zinc/57/88/04/1034578804.db2.gz AIJBVGXRVNNEQO-UHFFFAOYSA-N 1 1 331.416 4.348 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1cc(Cl)ccc1OCC1CC1 ZINC000430000016 1034847900 /nfs/dbraw/zinc/84/79/00/1034847900.db2.gz GJILFGZYQCBSBS-UHFFFAOYSA-N 1 1 346.814 4.327 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CSCc2ccccc21 ZINC000595011227 1035505057 /nfs/dbraw/zinc/50/50/57/1035505057.db2.gz CKMXIJAVWKKARP-YVEFUNNKSA-N 1 1 344.436 4.242 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H]1COc2c1ccc(C)c2C ZINC000595013052 1035506222 /nfs/dbraw/zinc/50/62/22/1035506222.db2.gz GJEJKSUSJSIQAE-DYVFJYSZSA-N 1 1 342.395 4.005 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000595018506 1035508685 /nfs/dbraw/zinc/50/86/85/1035508685.db2.gz QPVGREWMCAMYGB-BFQNTYOBSA-N 1 1 330.384 4.171 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1(c2ccc(F)cc2)CC1 ZINC000595023366 1035511400 /nfs/dbraw/zinc/51/14/00/1035511400.db2.gz PVKYIYSGZXGMOC-LBPRGKRZSA-N 1 1 330.359 4.082 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1C[C@@H](C)Oc2ccccc21 ZINC000595041034 1035565099 /nfs/dbraw/zinc/56/50/99/1035565099.db2.gz JFUSPYKOSYMLQG-PBFPGSCMSA-N 1 1 342.395 4.166 20 5 EIBDMO Cc1noc(C[N@H+](C)[C@H](C)[C@@H](C)c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000595334488 1035628634 /nfs/dbraw/zinc/62/86/34/1035628634.db2.gz QYBHFRFVRBCKES-ZYHUDNBSSA-N 1 1 337.807 4.169 20 5 EIBDMO CC(C)[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1F ZINC000595693762 1035764476 /nfs/dbraw/zinc/76/44/76/1035764476.db2.gz UJTMGQLSNDDTPI-SFHVURJKSA-N 1 1 342.374 4.097 20 5 EIBDMO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000491181089 1035816498 /nfs/dbraw/zinc/81/64/98/1035816498.db2.gz CAJOONUNPQNDOH-QGZVFWFLSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1ccccc1[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000491181089 1035816500 /nfs/dbraw/zinc/81/65/00/1035816500.db2.gz CAJOONUNPQNDOH-QGZVFWFLSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1ccc(C[N@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)c(OC)c1 ZINC000485712784 1036198368 /nfs/dbraw/zinc/19/83/68/1036198368.db2.gz AJTBGFRFVLSOQF-CQSZACIVSA-N 1 1 344.411 4.113 20 5 EIBDMO COc1ccc(C[N@@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)c(OC)c1 ZINC000485712784 1036198381 /nfs/dbraw/zinc/19/83/81/1036198381.db2.gz AJTBGFRFVLSOQF-CQSZACIVSA-N 1 1 344.411 4.113 20 5 EIBDMO CC[C@H]1c2ccsc2CC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC ZINC000016420405 1036409860 /nfs/dbraw/zinc/40/98/60/1036409860.db2.gz LXLUHILTGAAVOJ-HNNXBMFYSA-N 1 1 332.425 4.174 20 5 EIBDMO CC[C@H]1c2ccsc2CC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OC ZINC000016420405 1036409879 /nfs/dbraw/zinc/40/98/79/1036409879.db2.gz LXLUHILTGAAVOJ-HNNXBMFYSA-N 1 1 332.425 4.174 20 5 EIBDMO CC[C@@H]1c2ccsc2CC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC ZINC000016420406 1036410283 /nfs/dbraw/zinc/41/02/83/1036410283.db2.gz LXLUHILTGAAVOJ-OAHLLOKOSA-N 1 1 332.425 4.174 20 5 EIBDMO CC[C@@H]1c2ccsc2CC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OC ZINC000016420406 1036410286 /nfs/dbraw/zinc/41/02/86/1036410286.db2.gz LXLUHILTGAAVOJ-OAHLLOKOSA-N 1 1 332.425 4.174 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000589200204 1036709040 /nfs/dbraw/zinc/70/90/40/1036709040.db2.gz WJKXSVIJKNQLJS-LWUPMFFHSA-N 1 1 344.455 4.137 20 5 EIBDMO CCC[C@@H](C)[C@H]1CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000486802287 1036864537 /nfs/dbraw/zinc/86/45/37/1036864537.db2.gz WUWIAQGUIYBLLD-CZUORRHYSA-N 1 1 344.415 4.045 20 5 EIBDMO CC1(C)C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)c2cc(F)ccc2O1 ZINC000593674308 1036872838 /nfs/dbraw/zinc/87/28/38/1036872838.db2.gz PMAFOOFMUDDMKB-MRXNPFEDSA-N 1 1 348.349 4.265 20 5 EIBDMO C[C@H](c1cc2ccccc2o1)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000603662473 1036931986 /nfs/dbraw/zinc/93/19/86/1036931986.db2.gz CVECSEZXDGLEQF-CQSZACIVSA-N 1 1 340.379 4.413 20 5 EIBDMO CCOc1ccc([C@H]2CCC[N@@H+]2Cc2csc([N+](=O)[O-])c2)cc1 ZINC000603933530 1037094361 /nfs/dbraw/zinc/09/43/61/1037094361.db2.gz BIMBFAANXLPWAF-MRXNPFEDSA-N 1 1 332.425 4.392 20 5 EIBDMO CCOc1ccc([C@H]2CCC[N@H+]2Cc2csc([N+](=O)[O-])c2)cc1 ZINC000603933530 1037094377 /nfs/dbraw/zinc/09/43/77/1037094377.db2.gz BIMBFAANXLPWAF-MRXNPFEDSA-N 1 1 332.425 4.392 20 5 EIBDMO COc1ccccc1C1([NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000592395307 1037786895 /nfs/dbraw/zinc/78/68/95/1037786895.db2.gz WBWIZBXYQJMEHC-AWEZNQCLSA-N 1 1 326.396 4.252 20 5 EIBDMO COc1ccc(C[NH2+]C2(c3ccccc3Cl)CCC2)cc1[N+](=O)[O-] ZINC000593043072 1037909371 /nfs/dbraw/zinc/90/93/71/1037909371.db2.gz XFDVLVKXGFWWKM-UHFFFAOYSA-N 1 1 346.814 4.426 20 5 EIBDMO COc1cc(C[N@@H+](C2CC2)[C@H]2CCc3ccccc32)ccc1[N+](=O)[O-] ZINC000490015850 1038316194 /nfs/dbraw/zinc/31/61/94/1038316194.db2.gz WOTKDWNQXYOJMW-SFHVURJKSA-N 1 1 338.407 4.255 20 5 EIBDMO CN(C)c1cccc([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC000490405158 1038628939 /nfs/dbraw/zinc/62/89/39/1038628939.db2.gz WANIAHCBYWDZJX-IBGZPJMESA-N 1 1 343.402 4.137 20 5 EIBDMO CCCCOc1ncccc1C[NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000481422225 1039394224 /nfs/dbraw/zinc/39/42/24/1039394224.db2.gz KDYWJUJEULBBPY-GOSISDBHSA-N 1 1 343.427 4.410 20 5 EIBDMO CCCCOc1ncccc1C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000481427840 1039398584 /nfs/dbraw/zinc/39/85/84/1039398584.db2.gz YWDKMECLLMGMRH-OAHLLOKOSA-N 1 1 343.427 4.328 20 5 EIBDMO CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CCCc2cccnc21 ZINC000481438986 1039415061 /nfs/dbraw/zinc/41/50/61/1039415061.db2.gz SOJWIMXEOYQYFC-SFHVURJKSA-N 1 1 325.412 4.279 20 5 EIBDMO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@H]1CCCc2cccnc21 ZINC000481443978 1039438748 /nfs/dbraw/zinc/43/87/48/1039438748.db2.gz ZUOOBCKEITZWET-SFHVURJKSA-N 1 1 343.402 4.419 20 5 EIBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@H]1CCCc2cccnc21 ZINC000481443978 1039438756 /nfs/dbraw/zinc/43/87/56/1039438756.db2.gz ZUOOBCKEITZWET-SFHVURJKSA-N 1 1 343.402 4.419 20 5 EIBDMO CCC[N@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1CCCc2cccnc21 ZINC000481443995 1039440625 /nfs/dbraw/zinc/44/06/25/1039440625.db2.gz YZLMJKKGTRQCME-OAHLLOKOSA-N 1 1 331.441 4.341 20 5 EIBDMO CCC[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1CCCc2cccnc21 ZINC000481443995 1039440653 /nfs/dbraw/zinc/44/06/53/1039440653.db2.gz YZLMJKKGTRQCME-OAHLLOKOSA-N 1 1 331.441 4.341 20 5 EIBDMO Cc1ccoc1C[N@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000430109792 1039849138 /nfs/dbraw/zinc/84/91/38/1039849138.db2.gz FBMKHFGJYZKHTH-UHFFFAOYSA-N 1 1 326.352 4.388 20 5 EIBDMO Cc1ccoc1C[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000430109792 1039849143 /nfs/dbraw/zinc/84/91/43/1039849143.db2.gz FBMKHFGJYZKHTH-UHFFFAOYSA-N 1 1 326.352 4.388 20 5 EIBDMO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)s1 ZINC000122135576 1039883787 /nfs/dbraw/zinc/88/37/87/1039883787.db2.gz NQLQAIMPYGSDJS-ZDUSSCGKSA-N 1 1 333.457 4.424 20 5 EIBDMO C[N@H+]1CCC[C@@H](CNc2c(F)cccc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000553080535 1039978139 /nfs/dbraw/zinc/97/81/39/1039978139.db2.gz NNLRJDHUMWGOQO-SJCJKPOMSA-N 1 1 349.431 4.290 20 5 EIBDMO C[N@H+]1CCC[C@H](CNc2c(F)cccc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000553080536 1039978881 /nfs/dbraw/zinc/97/88/81/1039978881.db2.gz NNLRJDHUMWGOQO-SJKOYZFVSA-N 1 1 349.431 4.290 20 5 EIBDMO C[C@@H]1CCC[C@H]([N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000535562442 1040360878 /nfs/dbraw/zinc/36/08/78/1040360878.db2.gz XPEVXYQZNGANLT-DYVFJYSZSA-N 1 1 329.400 4.260 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[NH2+]C1(c2cccc(C(F)(F)F)c2)CC1 ZINC000477455400 1040511293 /nfs/dbraw/zinc/51/12/93/1040511293.db2.gz BRXHIEHFIJHYRY-UHFFFAOYSA-N 1 1 336.313 4.393 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@H](c4ccccc4)C3)co2)cc1 ZINC000089891090 1040527356 /nfs/dbraw/zinc/52/73/56/1040527356.db2.gz GVHDBCYFYJHNIS-KRWDZBQOSA-N 1 1 349.390 4.239 20 5 EIBDMO CCSCC[C@H](C)[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089913168 1040605352 /nfs/dbraw/zinc/60/53/52/1040605352.db2.gz YWSDMVAQEKDXPW-ZDUSSCGKSA-N 1 1 349.456 4.213 20 5 EIBDMO CC(C)CO[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000537724808 1040774801 /nfs/dbraw/zinc/77/48/01/1040774801.db2.gz FVXAPZVTJBUTAI-QGZVFWFLSA-N 1 1 344.411 4.102 20 5 EIBDMO CC[C@@H](NC[C@@H]1CCC[N@H+](CC(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000537950558 1040917829 /nfs/dbraw/zinc/91/78/29/1040917829.db2.gz CIDFOVIMDUABCP-QFBILLFUSA-N 1 1 333.476 4.004 20 5 EIBDMO CC[C@@H](NC[C@@H]1CCC[N@@H+](CC(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000537950558 1040917848 /nfs/dbraw/zinc/91/78/48/1040917848.db2.gz CIDFOVIMDUABCP-QFBILLFUSA-N 1 1 333.476 4.004 20 5 EIBDMO COCCCCc1ccc[nH+]c1NC/C=C/c1ccccc1[N+](=O)[O-] ZINC000462826807 1040976085 /nfs/dbraw/zinc/97/60/85/1040976085.db2.gz DVXHLAWJPFWNHU-UXBLZVDNSA-N 1 1 341.411 4.084 20 5 EIBDMO C[C@@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC12CCC2 ZINC000540042746 1041066654 /nfs/dbraw/zinc/06/66/54/1041066654.db2.gz KMAPDTMPBCUEAV-CQSZACIVSA-N 1 1 341.411 4.262 20 5 EIBDMO CC[C@@H]1CC[C@H](C)[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000540055677 1041075967 /nfs/dbraw/zinc/07/59/67/1041075967.db2.gz KARZZHQZLLMPKP-DZGCQCFKSA-N 1 1 329.400 4.055 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@H]1Cc1cccc(F)c1 ZINC000505802382 1041144927 /nfs/dbraw/zinc/14/49/27/1041144927.db2.gz NFQUVAYAELDWPB-HNNXBMFYSA-N 1 1 332.350 4.080 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3ccc(Cl)cn3)C2)cc1 ZINC000516148350 1041429641 /nfs/dbraw/zinc/42/96/41/1041429641.db2.gz KESXPSLSIMKNSD-AWEZNQCLSA-N 1 1 331.803 4.023 20 5 EIBDMO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC1 ZINC000517134403 1041879197 /nfs/dbraw/zinc/87/91/97/1041879197.db2.gz AFOSLQCBALXFQG-CHWSQXEVSA-N 1 1 344.415 4.044 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H](C)C[C@H]1c1ccccc1F ZINC000464725056 1042140779 /nfs/dbraw/zinc/14/07/79/1042140779.db2.gz LNVLPKBCIQYGEP-ACJLOTCBSA-N 1 1 344.386 4.326 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](C)C[C@H]1c1ccccc1F ZINC000464725056 1042140782 /nfs/dbraw/zinc/14/07/82/1042140782.db2.gz LNVLPKBCIQYGEP-ACJLOTCBSA-N 1 1 344.386 4.326 20 5 EIBDMO C[C@H]1C[C@@H](c2ccccc2F)[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000464729086 1042142653 /nfs/dbraw/zinc/14/26/53/1042142653.db2.gz ZGUSGFVDSNJEPY-LIRRHRJNSA-N 1 1 328.387 4.360 20 5 EIBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@@H]1CCSC1 ZINC000506235576 1042182415 /nfs/dbraw/zinc/18/24/15/1042182415.db2.gz WLRLTQVQGXMZTD-CQSZACIVSA-N 1 1 334.466 4.261 20 5 EIBDMO CCC[C@@]1(C)CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000464841020 1042192094 /nfs/dbraw/zinc/19/20/94/1042192094.db2.gz VYOWIJYCRVPFQE-SFHVURJKSA-N 1 1 344.415 4.047 20 5 EIBDMO C[C@@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@@H](c2ccco2)C1 ZINC000464858277 1042202999 /nfs/dbraw/zinc/20/29/99/1042202999.db2.gz OMBFQHGFHCWWLV-GDBMZVCRSA-N 1 1 330.384 4.040 20 5 EIBDMO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000271821896 1042412352 /nfs/dbraw/zinc/41/23/52/1042412352.db2.gz SHPWHZJOTXZWNG-STQMWFEESA-N 1 1 330.432 4.267 20 5 EIBDMO Cc1csc(C2([NH2+][C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)CCC2)n1 ZINC000271930748 1042525493 /nfs/dbraw/zinc/52/54/93/1042525493.db2.gz DNUAYBDNZQBOSV-ZDUSSCGKSA-N 1 1 331.441 4.398 20 5 EIBDMO CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@H](C)c1cccc(OC)c1 ZINC000518474148 1042539949 /nfs/dbraw/zinc/53/99/49/1042539949.db2.gz NRPDXSZCKNWDTH-OAHLLOKOSA-N 1 1 344.411 4.065 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCc2ccccc2)Cc2ccncc2)cc1 ZINC000518549324 1042566397 /nfs/dbraw/zinc/56/63/97/1042566397.db2.gz XSWPXNREZUSDSX-UHFFFAOYSA-N 1 1 347.418 4.235 20 5 EIBDMO CCOc1ccc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000506602375 1042674701 /nfs/dbraw/zinc/67/47/01/1042674701.db2.gz WOLUKOYTHKDNKA-UHFFFAOYSA-N 1 1 326.396 4.158 20 5 EIBDMO CCOc1ccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000506602375 1042674713 /nfs/dbraw/zinc/67/47/13/1042674713.db2.gz WOLUKOYTHKDNKA-UHFFFAOYSA-N 1 1 326.396 4.158 20 5 EIBDMO CC[C@](C)([NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1)c1nccs1 ZINC000152623682 1042921903 /nfs/dbraw/zinc/92/19/03/1042921903.db2.gz OUHINLZAJUCBTC-AWEZNQCLSA-N 1 1 325.821 4.120 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1cc2cccc(F)c2o1 ZINC000474004766 1042998766 /nfs/dbraw/zinc/99/87/66/1042998766.db2.gz AHPPGMZAKVOVQF-SNVBAGLBSA-N 1 1 332.306 4.470 20 5 EIBDMO CC1(C)C[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])c2ccc(F)cc2O1 ZINC000133286425 1043250903 /nfs/dbraw/zinc/25/09/03/1043250903.db2.gz HCIFOUUUUPSPML-HNNXBMFYSA-N 1 1 330.359 4.126 20 5 EIBDMO Cc1cccc(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000113317213 1043263381 /nfs/dbraw/zinc/26/33/81/1043263381.db2.gz NYMVNWYJQBTWKW-UHFFFAOYSA-N 1 1 339.420 4.317 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](Cc1ccco1)C(C)C ZINC000609194159 1043444592 /nfs/dbraw/zinc/44/45/92/1043444592.db2.gz XVAMPGHXTMFHAH-UHFFFAOYSA-N 1 1 332.400 4.386 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](Cc1ccco1)C(C)C ZINC000609194159 1043444604 /nfs/dbraw/zinc/44/46/04/1043444604.db2.gz XVAMPGHXTMFHAH-UHFFFAOYSA-N 1 1 332.400 4.386 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]Cc3ccsc3)cs2)c1 ZINC000172113811 1043719044 /nfs/dbraw/zinc/71/90/44/1043719044.db2.gz AGSXUCIIBQMPFF-UHFFFAOYSA-N 1 1 331.422 4.070 20 5 EIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCCCC[C@H]1c1ccco1 ZINC000078830981 1043795382 /nfs/dbraw/zinc/79/53/82/1043795382.db2.gz KKIRCFAUHVCRDY-HNNXBMFYSA-N 1 1 330.384 4.184 20 5 EIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCCCC[C@@H]1c1ccco1 ZINC000078830968 1043795593 /nfs/dbraw/zinc/79/55/93/1043795593.db2.gz KKIRCFAUHVCRDY-OAHLLOKOSA-N 1 1 330.384 4.184 20 5 EIBDMO CC[NH+](CC)Cc1ccccc1CN[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000079055518 1043835121 /nfs/dbraw/zinc/83/51/21/1043835121.db2.gz APKBUSAVADHYTO-INIZCTEOSA-N 1 1 341.455 4.287 20 5 EIBDMO Cc1ccc(-c2cc(C[NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3)on2)cc1 ZINC000173359645 1043916920 /nfs/dbraw/zinc/91/69/20/1043916920.db2.gz XXUZYPVPLGDNRN-AWEZNQCLSA-N 1 1 337.379 4.409 20 5 EIBDMO CCc1ccc([C@H]([NH2+]CCC(F)(F)F)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542494673 1043982450 /nfs/dbraw/zinc/98/24/50/1043982450.db2.gz MUFLSVKXMRHGIA-OAHLLOKOSA-N 1 1 342.317 4.382 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1cnc(C(C)C)nc1 ZINC000443063999 1043986043 /nfs/dbraw/zinc/98/60/43/1043986043.db2.gz OEECRIZTKOKICL-OVCLIPMQSA-N 1 1 340.427 4.044 20 5 EIBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@H]2c2ccc(F)c(F)c2)cc1 ZINC000732988573 1044065289 /nfs/dbraw/zinc/06/52/89/1044065289.db2.gz IUXHUGRIUFBCBI-SFHVURJKSA-N 1 1 332.350 4.253 20 5 EIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](C)C[C@@H](C)C1 ZINC000246483850 1044317824 /nfs/dbraw/zinc/31/78/24/1044317824.db2.gz AHOHHBNAHXWVSK-MGPQQGTHSA-N 1 1 344.415 4.074 20 5 EIBDMO CC(C)C[C@@H]1CCCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000123686112 1044753250 /nfs/dbraw/zinc/75/32/50/1044753250.db2.gz JVIVJBOLFCVJEE-INIZCTEOSA-N 1 1 344.415 4.045 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccc(OC(F)F)cc1 ZINC000487861998 1044793189 /nfs/dbraw/zinc/79/31/89/1044793189.db2.gz SCWSYQXPIXIZPU-LBPRGKRZSA-N 1 1 336.338 4.389 20 5 EIBDMO CCC[C@@H](NC1CC(C)(C)[NH2+]C(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000391887603 1044995200 /nfs/dbraw/zinc/99/52/00/1044995200.db2.gz XKMOKGRSHCWCBL-QGZVFWFLSA-N 1 1 333.476 4.335 20 5 EIBDMO Cc1nn(C[N@H+]2CCC[C@@H](C)[C@@H]2c2ccc(C)cc2)c(C)c1[N+](=O)[O-] ZINC000738284651 1045049602 /nfs/dbraw/zinc/04/96/02/1045049602.db2.gz MXGUXHQZFHGNBE-RDTXWAMCSA-N 1 1 342.443 4.147 20 5 EIBDMO Cc1nn(C[N@@H+]2CCC[C@@H](C)[C@@H]2c2ccc(C)cc2)c(C)c1[N+](=O)[O-] ZINC000738284651 1045049614 /nfs/dbraw/zinc/04/96/14/1045049614.db2.gz MXGUXHQZFHGNBE-RDTXWAMCSA-N 1 1 342.443 4.147 20 5 EIBDMO CCC[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 ZINC000611376554 1045297820 /nfs/dbraw/zinc/29/78/20/1045297820.db2.gz IVTMRLBICTXWGK-HNNXBMFYSA-N 1 1 325.368 4.367 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000611517048 1045320856 /nfs/dbraw/zinc/32/08/56/1045320856.db2.gz KYRSCGUKCBMUPN-GVDBMIGSSA-N 1 1 332.444 4.103 20 5 EIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H]1CCC2(CCCCCC2)O1 ZINC001170194375 1045933931 /nfs/dbraw/zinc/93/39/31/1045933931.db2.gz MKWPFHMWNPTNON-GOSISDBHSA-N 1 1 346.471 4.341 20 5 EIBDMO COc1ccc(C[C@@H](C)[N@H+]2CC[C@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001170327159 1045999875 /nfs/dbraw/zinc/99/98/75/1045999875.db2.gz FFELGILYTVCCJR-QAPCUYQASA-N 1 1 340.423 4.024 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000792877373 1046091139 /nfs/dbraw/zinc/09/11/39/1046091139.db2.gz JVUGKIIOFFZRTP-QGZVFWFLSA-N 1 1 341.367 4.230 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000792877373 1046091159 /nfs/dbraw/zinc/09/11/59/1046091159.db2.gz JVUGKIIOFFZRTP-QGZVFWFLSA-N 1 1 341.367 4.230 20 5 EIBDMO Cc1c(C[N@H+]2CCCCC[C@H]2c2ccncc2)cccc1[N+](=O)[O-] ZINC000917054507 1046581643 /nfs/dbraw/zinc/58/16/43/1046581643.db2.gz OKTMOSWJOGUFKR-IBGZPJMESA-N 1 1 325.412 4.416 20 5 EIBDMO CC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@H](C)c1cccc(OC)c1 ZINC000917106164 1046720859 /nfs/dbraw/zinc/72/08/59/1046720859.db2.gz SBQJICYHBRSPTN-CYBMUJFWSA-N 1 1 332.375 4.326 20 5 EIBDMO CC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@H](C)c1cccc(OC)c1 ZINC000917106164 1046720871 /nfs/dbraw/zinc/72/08/71/1046720871.db2.gz SBQJICYHBRSPTN-CYBMUJFWSA-N 1 1 332.375 4.326 20 5 EIBDMO Cc1ccc(N2CCC[N@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000917212448 1046816084 /nfs/dbraw/zinc/81/60/84/1046816084.db2.gz SREUAKDWNRTQPJ-QGZVFWFLSA-N 1 1 339.439 4.177 20 5 EIBDMO CC[C@@H](C)[N@H+](Cc1ccccc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000917455134 1046895024 /nfs/dbraw/zinc/89/50/24/1046895024.db2.gz RFJXJOIJSAMFRL-OAHLLOKOSA-N 1 1 338.411 4.203 20 5 EIBDMO CC[C@@H](C)[N@H+](Cc1ccccc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000917454460 1046895401 /nfs/dbraw/zinc/89/54/01/1046895401.db2.gz IBRSGZQYSDCDMZ-OAHLLOKOSA-N 1 1 338.411 4.203 20 5 EIBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000746672706 1046986281 /nfs/dbraw/zinc/98/62/81/1046986281.db2.gz HFDJHDXENSISPR-ZIAGYGMSSA-N 1 1 328.865 4.354 20 5 EIBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000788473355 1047197721 /nfs/dbraw/zinc/19/77/21/1047197721.db2.gz HRFASZSMVLLJMA-QGZVFWFLSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000788473355 1047197713 /nfs/dbraw/zinc/19/77/13/1047197713.db2.gz HRFASZSMVLLJMA-QGZVFWFLSA-N 1 1 330.359 4.080 20 5 EIBDMO Cc1cc([NH+]2CCCC2)ccc1N[C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788692832 1047264488 /nfs/dbraw/zinc/26/44/88/1047264488.db2.gz RGSIEMATZYDQHK-CQSZACIVSA-N 1 1 340.427 4.259 20 5 EIBDMO COc1ccc(C[N@@H+](C)C/C(C)=C\c2ccccc2)cc1[N+](=O)[O-] ZINC000556860237 1048077060 /nfs/dbraw/zinc/07/70/60/1048077060.db2.gz YMFFIBHIXYOFNG-PTNGSMBKSA-N 1 1 326.396 4.139 20 5 EIBDMO CCCO[C@@H]1CCC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000556878468 1048085945 /nfs/dbraw/zinc/08/59/45/1048085945.db2.gz YZCMZRVYELNCOR-QGZVFWFLSA-N 1 1 334.460 4.499 20 5 EIBDMO Cc1c(C[N@H+](Cc2cccc(O)c2)CC2CC2)cccc1[N+](=O)[O-] ZINC000499063840 1048140016 /nfs/dbraw/zinc/14/00/16/1048140016.db2.gz NONQXCVJSZPYBP-UHFFFAOYSA-N 1 1 326.396 4.021 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@]4(CC4(F)F)C3)o2)cc1 ZINC000846106474 1048822028 /nfs/dbraw/zinc/82/20/28/1048822028.db2.gz BQPCWQFQDBVLSS-KRWDZBQOSA-N 1 1 348.349 4.476 20 5 EIBDMO C[C@H]1CCCC[N@H+]1Cc1ccccc1CNc1ncc([N+](=O)[O-])s1 ZINC000195509033 1048886649 /nfs/dbraw/zinc/88/66/49/1048886649.db2.gz BDDWWICCEJHQEW-ZDUSSCGKSA-N 1 1 346.456 4.038 20 5 EIBDMO CC(C)[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H](C)c1ccsc1 ZINC000817287210 1048927895 /nfs/dbraw/zinc/92/78/95/1048927895.db2.gz LFQJWKXIADKCJD-SUMWQHHRSA-N 1 1 334.441 4.161 20 5 EIBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]Cc1ccc(F)cc1 ZINC000811472857 1049093133 /nfs/dbraw/zinc/09/31/33/1049093133.db2.gz PGEZBDTVLBLPIQ-UHFFFAOYSA-N 1 1 329.158 4.331 20 5 EIBDMO COc1ccc(C[N@H+]2[C@H](C)C[C@@H](c3ccccc3)[C@H]2C)cc1[N+](=O)[O-] ZINC001170638492 1049177853 /nfs/dbraw/zinc/17/78/53/1049177853.db2.gz JGHMKQBZRJTALB-IIDMSEBBSA-N 1 1 340.423 4.370 20 5 EIBDMO C[C@@H]1SCC[N@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000609829403 1049350093 /nfs/dbraw/zinc/35/00/93/1049350093.db2.gz AJNGFQRIJVFFNB-KSSFIOAISA-N 1 1 328.437 4.273 20 5 EIBDMO C[C@@H]1SCC[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000609829403 1049350103 /nfs/dbraw/zinc/35/01/03/1049350103.db2.gz AJNGFQRIJVFFNB-KSSFIOAISA-N 1 1 328.437 4.273 20 5 EIBDMO CC[C@H](C)[C@H]1CCCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000610002010 1049469183 /nfs/dbraw/zinc/46/91/83/1049469183.db2.gz TUTPRUXSCGAYIM-XJKSGUPXSA-N 1 1 344.415 4.045 20 5 EIBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1cc(F)cc(F)c1 ZINC000773043287 1049544812 /nfs/dbraw/zinc/54/48/12/1049544812.db2.gz YCEQCABNSZMOAW-VIFPVBQESA-N 1 1 326.730 4.377 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CSCCc3ccccc32)c1 ZINC000773042777 1049546004 /nfs/dbraw/zinc/54/60/04/1049546004.db2.gz WUUPBYKBYQSGMD-QGZVFWFLSA-N 1 1 348.855 4.368 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812849776 1049611786 /nfs/dbraw/zinc/61/17/86/1049611786.db2.gz JEEYNBKZLMOOTF-UGSOOPFHSA-N 1 1 348.830 4.192 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](Oc2ccccc2)C1 ZINC001171538548 1049733426 /nfs/dbraw/zinc/73/34/26/1049733426.db2.gz MOWJOZBKUMIJGY-QAPCUYQASA-N 1 1 326.396 4.118 20 5 EIBDMO COc1ccc(C2CC[NH+](Cc3csc([N+](=O)[O-])c3)CC2)cc1 ZINC000080630051 1050110841 /nfs/dbraw/zinc/11/08/41/1050110841.db2.gz LIEMVKGRDYYPAR-UHFFFAOYSA-N 1 1 332.425 4.045 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCc3c(F)cccc3C1)CC2 ZINC001172920566 1050234637 /nfs/dbraw/zinc/23/46/37/1050234637.db2.gz KRNYUVKONAQCEJ-KRWDZBQOSA-N 1 1 340.398 4.040 20 5 EIBDMO CC[N@@H+]([C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-])C1CCCCC1 ZINC001173184870 1050337438 /nfs/dbraw/zinc/33/74/38/1050337438.db2.gz PDNZPQVADIISGR-ZDUSSCGKSA-N 1 1 338.423 4.328 20 5 EIBDMO COc1ccc([C@@H]2CC[N@H+]([C@H](C)Cc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC001173230754 1050360561 /nfs/dbraw/zinc/36/05/61/1050360561.db2.gz FLLMWHYCTNXUBO-CRAIPNDOSA-N 1 1 340.423 4.024 20 5 EIBDMO C[C@H](c1ccccc1)[NH+]1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC001187462628 1050543261 /nfs/dbraw/zinc/54/32/61/1050543261.db2.gz DSBPKIOAUOCEIS-CQSZACIVSA-N 1 1 345.830 4.131 20 5 EIBDMO C[C@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC000775189460 1050826811 /nfs/dbraw/zinc/82/68/11/1050826811.db2.gz AXNUHWGASOXFMW-JTQLQIEISA-N 1 1 335.747 4.007 20 5 EIBDMO COC1(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCCCCC1 ZINC001179913687 1050831692 /nfs/dbraw/zinc/83/16/92/1050831692.db2.gz DLGIKKYCTBRFRJ-UHFFFAOYSA-N 1 1 332.444 4.299 20 5 EIBDMO COc1cc(F)cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC001180177743 1050894998 /nfs/dbraw/zinc/89/49/98/1050894998.db2.gz FOSVXPSJRISBPE-UHFFFAOYSA-N 1 1 332.375 4.153 20 5 EIBDMO CC[C@@H]1C[C@H](C)C[N@@H+]1Cc1cc(Br)c([N+](=O)[O-])s1 ZINC001180199376 1050926267 /nfs/dbraw/zinc/92/62/67/1050926267.db2.gz RJXWIEWJHRJXPL-DTWKUNHWSA-N 1 1 333.251 4.039 20 5 EIBDMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1cc(Br)c([N+](=O)[O-])s1 ZINC001180199376 1050926281 /nfs/dbraw/zinc/92/62/81/1050926281.db2.gz RJXWIEWJHRJXPL-DTWKUNHWSA-N 1 1 333.251 4.039 20 5 EIBDMO CC[C@H]1C[C@H](C)C[N@@H+]1Cc1cc(Br)c([N+](=O)[O-])s1 ZINC001180199377 1050927441 /nfs/dbraw/zinc/92/74/41/1050927441.db2.gz RJXWIEWJHRJXPL-IUCAKERBSA-N 1 1 333.251 4.039 20 5 EIBDMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1cc(Br)c([N+](=O)[O-])s1 ZINC001180199377 1050927454 /nfs/dbraw/zinc/92/74/54/1050927454.db2.gz RJXWIEWJHRJXPL-IUCAKERBSA-N 1 1 333.251 4.039 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCc2cc(Cl)ccc2C1 ZINC001180838089 1051083997 /nfs/dbraw/zinc/08/39/97/1051083997.db2.gz SYKWUQSANKXRMR-UHFFFAOYSA-N 1 1 330.815 4.423 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCc2cc(Cl)ccc2C1 ZINC001180838089 1051084009 /nfs/dbraw/zinc/08/40/09/1051084009.db2.gz SYKWUQSANKXRMR-UHFFFAOYSA-N 1 1 330.815 4.423 20 5 EIBDMO Cc1n[nH]c(C)c1[C@H]1CCCCC[N@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC001181524511 1051244395 /nfs/dbraw/zinc/24/43/95/1051244395.db2.gz BOJVDGYSRZHDJC-GOSISDBHSA-N 1 1 342.443 4.360 20 5 EIBDMO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1cc([N+](=O)[O-])ccc1Br ZINC001190865493 1051297166 /nfs/dbraw/zinc/29/71/66/1051297166.db2.gz VSWXVCPVYOSEJX-GHMZBOCLSA-N 1 1 327.222 4.120 20 5 EIBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)cc1 ZINC001191047483 1051347393 /nfs/dbraw/zinc/34/73/93/1051347393.db2.gz FWTFWSLSCFBJCQ-OAHLLOKOSA-N 1 1 346.814 4.117 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](c2ccccc2C)C[C@@H]1C ZINC001191156999 1051366994 /nfs/dbraw/zinc/36/69/94/1051366994.db2.gz PQSFKFDYWGRJAV-JKSUJKDBSA-N 1 1 340.423 4.290 20 5 EIBDMO CC(C)[C@H]1[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1(C)C ZINC001182101118 1051397658 /nfs/dbraw/zinc/39/76/58/1051397658.db2.gz YUPZMGSUAFBGKJ-CQSZACIVSA-N 1 1 330.350 4.480 20 5 EIBDMO COc1ccc(C[N@H+]2CCc3ccccc3[C@H]2C(C)C)cc1[N+](=O)[O-] ZINC001191542209 1051479131 /nfs/dbraw/zinc/47/91/31/1051479131.db2.gz YWFUKOMDXHUAOT-HXUWFJFHSA-N 1 1 340.423 4.359 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](Cc1ccccc1)C(C)(C)C ZINC001192052739 1051624976 /nfs/dbraw/zinc/62/49/76/1051624976.db2.gz IVWAJVZEXBOJGL-UHFFFAOYSA-N 1 1 328.412 4.404 20 5 EIBDMO Cc1cccc(C2=CC[N@@H+](CCOc3ccccc3[N+](=O)[O-])CC2)c1 ZINC001192557533 1051759138 /nfs/dbraw/zinc/75/91/38/1051759138.db2.gz SXYBGIZBSHOBHI-UHFFFAOYSA-N 1 1 338.407 4.071 20 5 EIBDMO C[C@H]1CC[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)[C@@H]1c1ccccc1 ZINC001176035790 1051881784 /nfs/dbraw/zinc/88/17/84/1051881784.db2.gz CUVIIQFBRXUUPT-SGTLLEGYSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@H]1CC[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)[C@@H]1c1ccccc1 ZINC001176035790 1051881785 /nfs/dbraw/zinc/88/17/85/1051881785.db2.gz CUVIIQFBRXUUPT-SGTLLEGYSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@@H](c1ccccc1)[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C1CC1 ZINC000774836250 1052182551 /nfs/dbraw/zinc/18/25/51/1052182551.db2.gz QXWRSWUUIMLZNC-ZDUSSCGKSA-N 1 1 341.367 4.229 20 5 EIBDMO C[C@@H](c1ccccc1)[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C1CC1 ZINC000774836250 1052182554 /nfs/dbraw/zinc/18/25/54/1052182554.db2.gz QXWRSWUUIMLZNC-ZDUSSCGKSA-N 1 1 341.367 4.229 20 5 EIBDMO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774884352 1052243892 /nfs/dbraw/zinc/24/38/92/1052243892.db2.gz KTQSBHFQKGKWME-QGZVFWFLSA-N 1 1 341.367 4.012 20 5 EIBDMO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774884352 1052243903 /nfs/dbraw/zinc/24/39/03/1052243903.db2.gz KTQSBHFQKGKWME-QGZVFWFLSA-N 1 1 341.367 4.012 20 5 EIBDMO CC[N@@H+](C[C@H](O)c1ccc(C)cc1)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000764285658 1053052131 /nfs/dbraw/zinc/05/21/31/1053052131.db2.gz YJKOQLKNTFYXJV-KXBFYZLASA-N 1 1 328.412 4.020 20 5 EIBDMO C[C@]1(Cc2cccc(F)c2)CCC[N@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001195393192 1053397251 /nfs/dbraw/zinc/39/72/51/1053397251.db2.gz AEQYSJWCFNHUBI-LJQANCHMSA-N 1 1 346.377 4.470 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3cccnc3)C2)c(Cl)c1 ZINC001195546247 1053432315 /nfs/dbraw/zinc/43/23/15/1053432315.db2.gz AGIXXFDRRYFGMC-AWEZNQCLSA-N 1 1 331.803 4.023 20 5 EIBDMO C[C@H](CSc1ccccc1)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC001195850773 1053495597 /nfs/dbraw/zinc/49/55/97/1053495597.db2.gz DFNFVDWDYDWHFZ-OAHLLOKOSA-N 1 1 346.452 4.086 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc(OC(F)F)cc1F)c1ccccc1[N+](=O)[O-] ZINC000865520998 1053535421 /nfs/dbraw/zinc/53/54/21/1053535421.db2.gz HMZMNNAYWVKGJD-SNVBAGLBSA-N 1 1 340.301 4.186 20 5 EIBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC3(CCCC3)[C@H]2c2ccco2)cc1 ZINC001196003965 1053552012 /nfs/dbraw/zinc/55/20/12/1053552012.db2.gz FLBRPZRGNVWVIJ-GOSISDBHSA-N 1 1 326.396 4.348 20 5 EIBDMO CCCC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H](C)c1ccc(C)o1 ZINC000776579607 1053563601 /nfs/dbraw/zinc/56/36/01/1053563601.db2.gz NZKHNCYLYJXMTK-QAPCUYQASA-N 1 1 346.427 4.393 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@H]([C@@H]2CCCCO2)C1 ZINC000852594174 1053595056 /nfs/dbraw/zinc/59/50/56/1053595056.db2.gz AGQZIPXNMOTSDV-GUYCJALGSA-N 1 1 338.835 4.029 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC([C@@H]3CCCCO3)CC2)c1 ZINC000852595936 1053595698 /nfs/dbraw/zinc/59/56/98/1053595698.db2.gz WHJPYOLBFIFASX-KRWDZBQOSA-N 1 1 338.835 4.029 20 5 EIBDMO COc1ccc2c(c1)CC[C@H]2[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000866305351 1053684331 /nfs/dbraw/zinc/68/43/31/1053684331.db2.gz PLTMNMNFEXAAPS-QGZVFWFLSA-N 1 1 332.787 4.034 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1noc3cc(F)ccc31)CCC2 ZINC000866612305 1053804017 /nfs/dbraw/zinc/80/40/17/1053804017.db2.gz GOZDURCRDRAJHS-INIZCTEOSA-N 1 1 341.342 4.042 20 5 EIBDMO Cc1cc(NC[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000301402485 1053870513 /nfs/dbraw/zinc/87/05/13/1053870513.db2.gz DBHHFAZWGOOULM-KSSFIOAISA-N 1 1 345.468 4.460 20 5 EIBDMO Cc1ccc(N2CCC(Nc3ccc(Cl)cc3[N+](=O)[O-])CC2)[nH+]c1 ZINC000301409239 1053870750 /nfs/dbraw/zinc/87/07/50/1053870750.db2.gz XBGOYTGVKIQYBP-UHFFFAOYSA-N 1 1 346.818 4.033 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1C[C@@H]2C[C@]2(c2ccccc2)C1 ZINC001197718672 1053971375 /nfs/dbraw/zinc/97/13/75/1053971375.db2.gz AFXUYHFZEOSRJC-MAUKXSAKSA-N 1 1 328.799 4.022 20 5 EIBDMO CC[C@@H](C[N@@H+](CC)C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000775895278 1054281014 /nfs/dbraw/zinc/28/10/14/1054281014.db2.gz KZCBEYIBUICLPJ-JXFKEZNVSA-N 1 1 342.439 4.144 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ncc(Cl)s1)CCCC2 ZINC000872111571 1054392065 /nfs/dbraw/zinc/39/20/65/1054392065.db2.gz CAGRJLBRMVLEEH-CYBMUJFWSA-N 1 1 337.832 4.262 20 5 EIBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273252908 1055567263 /nfs/dbraw/zinc/56/72/63/1055567263.db2.gz AJALDVBIYHJLNO-RBUKOAKNSA-N 1 1 344.386 4.086 20 5 EIBDMO CC[C@@H]([NH2+][C@@H]1CCCc2cn(C(C)C)nc21)c1cccc([N+](=O)[O-])c1 ZINC000765821229 1055647563 /nfs/dbraw/zinc/64/75/63/1055647563.db2.gz NLIQQPPWALNLRR-QZTJIDSGSA-N 1 1 342.443 4.491 20 5 EIBDMO C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000301561587 1055733657 /nfs/dbraw/zinc/73/36/57/1055733657.db2.gz UXKWDNSFYFRHCI-MAUKXSAKSA-N 1 1 325.412 4.060 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCCc2cn(C(C)C)nc21 ZINC000765822228 1055749071 /nfs/dbraw/zinc/74/90/71/1055749071.db2.gz ZFKYTSGHINGXFR-KBXCAEBGSA-N 1 1 342.443 4.409 20 5 EIBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273409122 1055804194 /nfs/dbraw/zinc/80/41/94/1055804194.db2.gz HZWNMMWWHFWJDQ-MJGOQNOKSA-N 1 1 344.386 4.086 20 5 EIBDMO Cc1c([C@H](C)[NH2+][C@H]2c3ccc(F)cc3O[C@H]2C)cccc1[N+](=O)[O-] ZINC000554089417 1056001553 /nfs/dbraw/zinc/00/15/53/1056001553.db2.gz YDFRCRKJYRWANP-OAVHHTNSSA-N 1 1 330.359 4.215 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1c2ccc(F)cc2O[C@@H]1C ZINC000554090302 1056008332 /nfs/dbraw/zinc/00/83/32/1056008332.db2.gz PRCLUTSHRCXFJC-VNBZBWLYSA-N 1 1 330.359 4.215 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2c(Cl)n[nH]c2C2CC2)cc1[N+](=O)[O-] ZINC000921818891 1056639196 /nfs/dbraw/zinc/63/91/96/1056639196.db2.gz TWXNYEMDHQDJNX-SNVBAGLBSA-N 1 1 334.807 4.008 20 5 EIBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1cccc(OC(F)F)c1 ZINC001168686253 1056734445 /nfs/dbraw/zinc/73/44/45/1056734445.db2.gz QQMRHNSAMORCAV-JTQLQIEISA-N 1 1 340.301 4.186 20 5 EIBDMO CCc1ccc(N2CC[NH+]([C@@H](C)c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000743868345 1059181734 /nfs/dbraw/zinc/18/17/34/1059181734.db2.gz VIPHKZOYXAGWBN-INIZCTEOSA-N 1 1 339.439 4.040 20 5 EIBDMO COc1ccc2c(c1)CCC[C@H]2[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000746141236 1060043596 /nfs/dbraw/zinc/04/35/96/1060043596.db2.gz SVORCCVZJXAQCY-LJQANCHMSA-N 1 1 344.386 4.252 20 5 EIBDMO COCCCC[N@@H+](Cc1ccccc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000145019263 1060256899 /nfs/dbraw/zinc/25/68/99/1060256899.db2.gz KTJFBVHUOLFZHM-UHFFFAOYSA-N 1 1 346.402 4.163 20 5 EIBDMO Cc1ccc(C(C)(C)Nc2ccc([N+](=O)[O-])c3c2CC[N@@H+](C)C3)cc1 ZINC001168805484 1060409367 /nfs/dbraw/zinc/40/93/67/1060409367.db2.gz YIBLXOVMFQGAHH-UHFFFAOYSA-N 1 1 339.439 4.238 20 5 EIBDMO Cc1ccc(C(C)(C)Nc2ccc([N+](=O)[O-])c3c2CC[N@H+](C)C3)cc1 ZINC001168805484 1060409380 /nfs/dbraw/zinc/40/93/80/1060409380.db2.gz YIBLXOVMFQGAHH-UHFFFAOYSA-N 1 1 339.439 4.238 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC001168958772 1060556045 /nfs/dbraw/zinc/55/60/45/1060556045.db2.gz ZUKHDSVKPIHSRL-GOSISDBHSA-N 1 1 326.396 4.331 20 5 EIBDMO CC[C@H]1Cc2ccccc2C[N@@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC001169013632 1060577288 /nfs/dbraw/zinc/57/72/88/1060577288.db2.gz INNVVCKHCQZGAS-INIZCTEOSA-N 1 1 344.386 4.079 20 5 EIBDMO CC[C@H]1Cc2ccccc2C[N@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC001169013632 1060577310 /nfs/dbraw/zinc/57/73/10/1060577310.db2.gz INNVVCKHCQZGAS-INIZCTEOSA-N 1 1 344.386 4.079 20 5 EIBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@H](c3cccc(Cl)c3Cl)C2)C1 ZINC001169035903 1060593380 /nfs/dbraw/zinc/59/33/80/1060593380.db2.gz MGMPLSUKMMDXAT-AGIUHOORSA-N 1 1 343.254 4.228 20 5 EIBDMO C[N@@H+](Cc1ccc(Oc2ccccc2)cc1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169037066 1060596055 /nfs/dbraw/zinc/59/60/55/1060596055.db2.gz IOWGFBKHAGBIPW-MSOLQXFVSA-N 1 1 340.423 4.356 20 5 EIBDMO CC[N@@H+](Cc1ccc(Cl)cc1Cl)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169044852 1060598253 /nfs/dbraw/zinc/59/82/53/1060598253.db2.gz JCJIIPKWIZCECD-RISCZKNCSA-N 1 1 331.243 4.261 20 5 EIBDMO CCC[C@]1(COC)CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC001169781097 1060967409 /nfs/dbraw/zinc/96/74/09/1060967409.db2.gz RSDAMPLURPHCCS-MRXNPFEDSA-N 1 1 326.824 4.029 20 5 EIBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCCCC[C@@H]2c2ccco2)c1 ZINC000078831613 217130287 /nfs/dbraw/zinc/13/02/87/217130287.db2.gz FTFJFMUVJGAHKV-QGZVFWFLSA-N 1 1 330.384 4.184 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccnc3ccccc23)C2CC2)c1 ZINC000536638692 1032325726 /nfs/dbraw/zinc/32/57/26/1032325726.db2.gz KYGVGXFHERBBTK-UHFFFAOYSA-N 1 1 333.391 4.308 20 5 EIBDMO COc1cccc(C=C2CC[NH+](Cc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000532378592 1032398654 /nfs/dbraw/zinc/39/86/54/1032398654.db2.gz HPSVPRGNOJHBNY-UHFFFAOYSA-N 1 1 338.407 4.283 20 5 EIBDMO C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000475721410 1032500594 /nfs/dbraw/zinc/50/05/94/1032500594.db2.gz AZNFBCZTZKPUIA-ILXRZTDVSA-N 1 1 343.427 4.159 20 5 EIBDMO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccc([N+](=O)[O-])cc2OC)s1 ZINC000430216154 1019416259 /nfs/dbraw/zinc/41/62/59/1019416259.db2.gz DWBPSGBFMYWPMV-GFCCVEGCSA-N 1 1 349.456 4.124 20 5 EIBDMO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2OC)s1 ZINC000430216154 1019416265 /nfs/dbraw/zinc/41/62/65/1019416265.db2.gz DWBPSGBFMYWPMV-GFCCVEGCSA-N 1 1 349.456 4.124 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)c1cc2cccc(F)c2o1 ZINC000430238265 1019562369 /nfs/dbraw/zinc/56/23/69/1019562369.db2.gz KPMTUDNUWBNJAV-NSHDSACASA-N 1 1 344.342 4.340 20 5 EIBDMO Cc1ccc([C@H](C)[N@@H+](C)CCOc2ccccc2[N+](=O)[O-])c(C)c1 ZINC001167145820 1020365847 /nfs/dbraw/zinc/36/58/47/1020365847.db2.gz IKJHLJDQCRUQRB-INIZCTEOSA-N 1 1 328.412 4.283 20 5 EIBDMO C[C@H](C1CC1)[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C1CC1 ZINC001167261597 1020716527 /nfs/dbraw/zinc/71/65/27/1020716527.db2.gz CNFRXBWOBWYPDN-SNVBAGLBSA-N 1 1 339.233 4.120 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC001167332383 1021194089 /nfs/dbraw/zinc/19/40/89/1021194089.db2.gz KFZCHRKZOOWJAQ-QGZVFWFLSA-N 1 1 340.423 4.058 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000610369753 1021551079 /nfs/dbraw/zinc/55/10/79/1021551079.db2.gz SSJYTLQQDMOKQJ-KBXCAEBGSA-N 1 1 328.437 4.446 20 5 EIBDMO COCCc1cc[nH+]c(N[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)c1 ZINC000582232970 1021922360 /nfs/dbraw/zinc/92/23/60/1021922360.db2.gz VLMQGDPTJWQYIX-QGZVFWFLSA-N 1 1 341.411 4.013 20 5 EIBDMO COc1cccc([C@H]2C[C@H](C)C[N@@H+]2Cc2csc([N+](=O)[O-])c2)c1 ZINC000541320195 1022698472 /nfs/dbraw/zinc/69/84/72/1022698472.db2.gz HEXHKLCFDIMTEP-BLLLJJGKSA-N 1 1 332.425 4.248 20 5 EIBDMO COc1cccc([C@H]2C[C@H](C)C[N@H+]2Cc2csc([N+](=O)[O-])c2)c1 ZINC000541320195 1022698487 /nfs/dbraw/zinc/69/84/87/1022698487.db2.gz HEXHKLCFDIMTEP-BLLLJJGKSA-N 1 1 332.425 4.248 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC[C@@H]3C3CCC3)o2)c1 ZINC000104694661 1022699441 /nfs/dbraw/zinc/69/94/41/1022699441.db2.gz FVUVKZDMFRLIKP-QGZVFWFLSA-N 1 1 341.411 4.057 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](c1ccccn1)C1CCCC1 ZINC000378434402 1022816890 /nfs/dbraw/zinc/81/68/90/1022816890.db2.gz RPVQALVDVJTTCF-IBGZPJMESA-N 1 1 341.411 4.020 20 5 EIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000610481077 1022842951 /nfs/dbraw/zinc/84/29/51/1022842951.db2.gz UHMFZWXLBDSZMK-SFHVURJKSA-N 1 1 342.395 4.036 20 5 EIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000610481077 1022842953 /nfs/dbraw/zinc/84/29/53/1022842953.db2.gz UHMFZWXLBDSZMK-SFHVURJKSA-N 1 1 342.395 4.036 20 5 EIBDMO Cc1cccc2c1OCC[C@H]2[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000188880611 1022951752 /nfs/dbraw/zinc/95/17/52/1022951752.db2.gz ZPOIROXNNQQZRG-MRXNPFEDSA-N 1 1 332.787 4.170 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(Cl)ccc2OC(F)F)cc1 ZINC000077221000 1023019384 /nfs/dbraw/zinc/01/93/84/1023019384.db2.gz LJKWDVISJGBQOZ-UHFFFAOYSA-N 1 1 342.729 4.139 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC[C@H]4CCC[C@@H]43)o2)c1 ZINC000072693718 1023024829 /nfs/dbraw/zinc/02/48/29/1023024829.db2.gz OVWDZDQDARQAOM-PBHICJAKSA-N 1 1 341.411 4.057 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC2(CCOCC2)[C@H]1C(C)C ZINC000414523134 1023248864 /nfs/dbraw/zinc/24/88/64/1023248864.db2.gz CVHQFVPASMIICB-KZIRBZLESA-N 1 1 344.455 4.135 20 5 EIBDMO C[C@@H]([NH2+][C@@H](C)c1nccn1-c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000376802733 1023313437 /nfs/dbraw/zinc/31/34/37/1023313437.db2.gz SJEOVEBAPWUILS-CABCVRRESA-N 1 1 336.395 4.192 20 5 EIBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000051133694 1023468982 /nfs/dbraw/zinc/46/89/82/1023468982.db2.gz CBVIPPNTAUSFOJ-UYAOXDASSA-N 1 1 340.423 4.195 20 5 EIBDMO COc1ccc(Cl)cc1C[N@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000108066293 1023985420 /nfs/dbraw/zinc/98/54/20/1023985420.db2.gz ICBBHKUOFHCNIP-UHFFFAOYSA-N 1 1 334.803 4.197 20 5 EIBDMO COc1ccc(Cl)cc1C[N@@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000108066293 1023985463 /nfs/dbraw/zinc/98/54/63/1023985463.db2.gz ICBBHKUOFHCNIP-UHFFFAOYSA-N 1 1 334.803 4.197 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@H]3C3CCCCC3)nc2c1 ZINC000610581307 1024114792 /nfs/dbraw/zinc/11/47/92/1024114792.db2.gz WJYYRRGAHNZTIN-MRXNPFEDSA-N 1 1 329.400 4.281 20 5 EIBDMO CCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccc(C)cc1 ZINC000610581700 1024132809 /nfs/dbraw/zinc/13/28/09/1024132809.db2.gz DFKBHQLBXMMVHX-UHFFFAOYSA-N 1 1 339.395 4.457 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC(c2ccncc2)CC1 ZINC000277280779 1025457077 /nfs/dbraw/zinc/45/70/77/1025457077.db2.gz SGYIRHRTQMNQEQ-UHFFFAOYSA-N 1 1 331.803 4.023 20 5 EIBDMO CC[C@@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)c1cccc([N+](=O)[O-])c1 ZINC000278917209 1025561118 /nfs/dbraw/zinc/56/11/18/1025561118.db2.gz WKFKSFCNLORTDV-OAHLLOKOSA-N 1 1 339.317 4.250 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCC[C@@H]3C3CCCC3)c2)cc1 ZINC000728899525 1026259448 /nfs/dbraw/zinc/25/94/48/1026259448.db2.gz VWGWSXFRACEBDY-LJQANCHMSA-N 1 1 340.427 4.070 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCC[C@H]3C3CCCC3)c2)cc1 ZINC000728899524 1026260434 /nfs/dbraw/zinc/26/04/34/1026260434.db2.gz VWGWSXFRACEBDY-IBGZPJMESA-N 1 1 340.427 4.070 20 5 EIBDMO CC(C)(C)OC1CC([N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000451551720 1026369029 /nfs/dbraw/zinc/36/90/29/1026369029.db2.gz UUHJRDMPSOSLPT-FAEJEUNOSA-N 1 1 332.444 4.120 20 5 EIBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cnc(C(C)(C)C)nc1 ZINC000342778098 1026486835 /nfs/dbraw/zinc/48/68/35/1026486835.db2.gz JWZDUKBZFCZJPK-UHFFFAOYSA-N 1 1 342.443 4.093 20 5 EIBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cnc(C(C)(C)C)nc1 ZINC000342778098 1026486850 /nfs/dbraw/zinc/48/68/50/1026486850.db2.gz JWZDUKBZFCZJPK-UHFFFAOYSA-N 1 1 342.443 4.093 20 5 EIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](C)C[C@@H](C)C1 ZINC000127565003 1026564286 /nfs/dbraw/zinc/56/42/86/1026564286.db2.gz AHOHHBNAHXWVSK-MCIONIFRSA-N 1 1 344.415 4.074 20 5 EIBDMO CCCO[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000182159161 1026619829 /nfs/dbraw/zinc/61/98/29/1026619829.db2.gz VORNVQCKUWUNEP-HNNXBMFYSA-N 1 1 326.824 4.029 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@H](COc3ccccc3)C2)ccc1Cl ZINC000780365349 1026632590 /nfs/dbraw/zinc/63/25/90/1026632590.db2.gz LOLHHSFXZBHWLL-OAHLLOKOSA-N 1 1 346.814 4.149 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](COc3ccccc3)C2)ccc1Cl ZINC000780365349 1026632606 /nfs/dbraw/zinc/63/26/06/1026632606.db2.gz LOLHHSFXZBHWLL-OAHLLOKOSA-N 1 1 346.814 4.149 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2ccc(F)cc2)C(C)C)cc1[N+](=O)[O-] ZINC000507168981 1026681420 /nfs/dbraw/zinc/68/14/20/1026681420.db2.gz TZUJNBGVEHXOTD-UHFFFAOYSA-N 1 1 332.375 4.153 20 5 EIBDMO C[C@@H](c1cccs1)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000507431965 1026793031 /nfs/dbraw/zinc/79/30/31/1026793031.db2.gz GXLBJMXGXDDFRN-JTQLQIEISA-N 1 1 342.367 4.451 20 5 EIBDMO C[C@@H](c1cccs1)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000507431965 1026793039 /nfs/dbraw/zinc/79/30/39/1026793039.db2.gz GXLBJMXGXDDFRN-JTQLQIEISA-N 1 1 342.367 4.451 20 5 EIBDMO CC[C@H]1C[C@@]1([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1cccc(C)c1 ZINC000500507183 1026806001 /nfs/dbraw/zinc/80/60/01/1026806001.db2.gz HIROHHCRWBJJAB-KXBFYZLASA-N 1 1 328.387 4.457 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H](C)C[C@H]1c1cccc(F)c1 ZINC000441325902 1027461635 /nfs/dbraw/zinc/46/16/35/1027461635.db2.gz UKVJDOBPDLIDKC-UGSOOPFHSA-N 1 1 344.386 4.326 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](C)C[C@H]1c1cccc(F)c1 ZINC000441325902 1027461639 /nfs/dbraw/zinc/46/16/39/1027461639.db2.gz UKVJDOBPDLIDKC-UGSOOPFHSA-N 1 1 344.386 4.326 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000441401217 1027526033 /nfs/dbraw/zinc/52/60/33/1027526033.db2.gz XUZQZULIUKAJAR-KURKYZTESA-N 1 1 345.487 4.242 20 5 EIBDMO CC(C)(C)c1ccc(N(C(N)=[NH2+])c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC001167990852 1027596718 /nfs/dbraw/zinc/59/67/18/1027596718.db2.gz AEFKPVCWIONEED-UHFFFAOYSA-N 1 1 330.363 4.063 20 5 EIBDMO CO[C@@]1(C)CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000475577146 1027701226 /nfs/dbraw/zinc/70/12/26/1027701226.db2.gz ZNHBETHRVOJLAK-IBGZPJMESA-N 1 1 344.411 4.246 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000186697507 1027822708 /nfs/dbraw/zinc/82/27/08/1027822708.db2.gz AMRLLNXEWUFIGY-FOIQADDNSA-N 1 1 338.407 4.096 20 5 EIBDMO Cc1ccc(C)c([C@@H](C)[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444588882 1027877666 /nfs/dbraw/zinc/87/76/66/1027877666.db2.gz HAODVFJBXSOTQC-CQSZACIVSA-N 1 1 338.411 4.281 20 5 EIBDMO Cc1ccc(C)c([C@@H](C)[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444588882 1027877670 /nfs/dbraw/zinc/87/76/70/1027877670.db2.gz HAODVFJBXSOTQC-CQSZACIVSA-N 1 1 338.411 4.281 20 5 EIBDMO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)s1 ZINC000444639532 1027937149 /nfs/dbraw/zinc/93/71/49/1027937149.db2.gz AIBDOMYODKKXKK-HNNXBMFYSA-N 1 1 342.424 4.178 20 5 EIBDMO Cc1ccc([C@@H]2CCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)s1 ZINC000444639532 1027937161 /nfs/dbraw/zinc/93/71/61/1027937161.db2.gz AIBDOMYODKKXKK-HNNXBMFYSA-N 1 1 342.424 4.178 20 5 EIBDMO CC1CCC([N@H+](Cc2csc([N+](=O)[O-])c2)C[C@H]2CCCO2)CC1 ZINC000441442255 1027983517 /nfs/dbraw/zinc/98/35/17/1027983517.db2.gz SSMMZIJIFOIOLV-AVVWSFFYSA-N 1 1 338.473 4.216 20 5 EIBDMO CC(C)[C@@H]1CCC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000444749603 1028037007 /nfs/dbraw/zinc/03/70/07/1028037007.db2.gz UBNTYOMNQRJPGN-DZGCQCFKSA-N 1 1 344.415 4.074 20 5 EIBDMO CC[C@H]1CCCCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000536372446 1028199440 /nfs/dbraw/zinc/19/94/40/1028199440.db2.gz XTXYGUWRFUEKCJ-INIZCTEOSA-N 1 1 329.400 4.404 20 5 EIBDMO CN(C)c1cc(NC(=O)c2cc3ccccc3c3cccnc23)cc[nH+]1 ZINC000346933637 1028822834 /nfs/dbraw/zinc/82/28/34/1028822834.db2.gz QRIXESIKVMOXFA-UHFFFAOYSA-N 1 1 342.402 4.101 20 5 EIBDMO CC[C@@]1(C)CCC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000245458095 1028860487 /nfs/dbraw/zinc/86/04/87/1028860487.db2.gz UTABCUCALHOWCQ-ACJLOTCBSA-N 1 1 344.415 4.218 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H](c2cncc(F)c2)C2CC2)c1 ZINC000281789402 1028871728 /nfs/dbraw/zinc/87/17/28/1028871728.db2.gz XQRDZTRLOBEPNP-MRXNPFEDSA-N 1 1 335.766 4.023 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](C(F)(F)F)[C@H]1C ZINC000475281504 1029496974 /nfs/dbraw/zinc/49/69/74/1029496974.db2.gz PNBGXSSKBMLFIJ-SLSOJXQNSA-N 1 1 328.334 4.271 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@H]4CCC[C@H]43)cs2)c1 ZINC000428451746 1029533994 /nfs/dbraw/zinc/53/39/94/1029533994.db2.gz FKKQQIOKMKOKLE-MLGOLLRUSA-N 1 1 329.425 4.093 20 5 EIBDMO C[C@@]1(O)CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000475334057 1029561892 /nfs/dbraw/zinc/56/18/92/1029561892.db2.gz USFATZJLYCRUJB-GOSISDBHSA-N 1 1 346.452 4.060 20 5 EIBDMO CC(C)c1ccc(C[N@@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000584323634 1029735974 /nfs/dbraw/zinc/73/59/74/1029735974.db2.gz XVTBHMZLYUZJKU-OALUTQOASA-N 1 1 344.455 4.252 20 5 EIBDMO CC(C)c1ccc(C[N@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000584323634 1029735978 /nfs/dbraw/zinc/73/59/78/1029735978.db2.gz XVTBHMZLYUZJKU-OALUTQOASA-N 1 1 344.455 4.252 20 5 EIBDMO CCOc1cc(C[N@@H+]2CC[C@@H](C(F)(F)F)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000451410578 1030466086 /nfs/dbraw/zinc/46/60/86/1030466086.db2.gz SRRAVWQIALQGJQ-WCQYABFASA-N 1 1 346.349 4.156 20 5 EIBDMO CCOc1cc(C[N@H+]2CC[C@@H](C(F)(F)F)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000451410578 1030466088 /nfs/dbraw/zinc/46/60/88/1030466088.db2.gz SRRAVWQIALQGJQ-WCQYABFASA-N 1 1 346.349 4.156 20 5 EIBDMO CCOc1cc(C[N@@H+]2CC[C@H](C(F)(F)F)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000451410576 1030473991 /nfs/dbraw/zinc/47/39/91/1030473991.db2.gz SRRAVWQIALQGJQ-AAEUAGOBSA-N 1 1 346.349 4.156 20 5 EIBDMO CCOc1cc(C[N@H+]2CC[C@H](C(F)(F)F)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000451410576 1030474003 /nfs/dbraw/zinc/47/40/03/1030474003.db2.gz SRRAVWQIALQGJQ-AAEUAGOBSA-N 1 1 346.349 4.156 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](Cc1ccccn1)C(C)C ZINC000527304343 1030608421 /nfs/dbraw/zinc/60/84/21/1030608421.db2.gz BQLZQPSASQMHJD-WJDWOHSUSA-N 1 1 325.412 4.304 20 5 EIBDMO Cc1ncc(C[N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)s1 ZINC000179381751 1031040050 /nfs/dbraw/zinc/04/00/50/1031040050.db2.gz GUFVQIGMJFAPQB-UHFFFAOYSA-N 1 1 343.408 4.252 20 5 EIBDMO Cc1ncc(C[N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)s1 ZINC000179381751 1031040069 /nfs/dbraw/zinc/04/00/69/1031040069.db2.gz GUFVQIGMJFAPQB-UHFFFAOYSA-N 1 1 343.408 4.252 20 5 EIBDMO Cc1nc2ccccc2nc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000179521299 1031199550 /nfs/dbraw/zinc/19/95/50/1031199550.db2.gz XDYNRIXZPSSJPE-UHFFFAOYSA-N 1 1 348.406 4.011 20 5 EIBDMO Cc1nc2ccccc2nc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000179521299 1031199567 /nfs/dbraw/zinc/19/95/67/1031199567.db2.gz XDYNRIXZPSSJPE-UHFFFAOYSA-N 1 1 348.406 4.011 20 5 EIBDMO C[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1cccc(OC(F)F)c1 ZINC000179581408 1031221273 /nfs/dbraw/zinc/22/12/73/1031221273.db2.gz VLQMLTQACITKSS-JTQLQIEISA-N 1 1 340.301 4.186 20 5 EIBDMO C[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1cccc(OC(F)F)c1 ZINC000179581421 1031223860 /nfs/dbraw/zinc/22/38/60/1031223860.db2.gz VLQMLTQACITKSS-SNVBAGLBSA-N 1 1 340.301 4.186 20 5 EIBDMO C[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc(OC(F)F)cc1 ZINC000179611089 1031225482 /nfs/dbraw/zinc/22/54/82/1031225482.db2.gz NJYPPNWUPOFEQD-JTQLQIEISA-N 1 1 340.301 4.186 20 5 EIBDMO CC(C)(C)OCc1cccc(C[NH2+]Cc2csc([N+](=O)[O-])c2)c1 ZINC000236575417 1031507594 /nfs/dbraw/zinc/50/75/94/1031507594.db2.gz MFFMFLXUPYDSBN-UHFFFAOYSA-N 1 1 334.441 4.261 20 5 EIBDMO CCO[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C ZINC000449495021 1031803320 /nfs/dbraw/zinc/80/33/20/1031803320.db2.gz NTKLNKXAQTXCNX-KSSFIOAISA-N 1 1 344.411 4.102 20 5 EIBDMO CC(C)[N@@H+]1CCC[C@H](CN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433172789 1033992909 /nfs/dbraw/zinc/99/29/09/1033992909.db2.gz DMIDMUCHSUUPFY-DNVCBOLYSA-N 1 1 345.487 4.027 20 5 EIBDMO CC(C)[N@H+]1CCC[C@H](CN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433172789 1033992924 /nfs/dbraw/zinc/99/29/24/1033992924.db2.gz DMIDMUCHSUUPFY-DNVCBOLYSA-N 1 1 345.487 4.027 20 5 EIBDMO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccc(C(C)C)c([N+](=O)[O-])c2)on1 ZINC000509818480 1034050788 /nfs/dbraw/zinc/05/07/88/1034050788.db2.gz HQCJAPMWMVMUJA-INIZCTEOSA-N 1 1 329.400 4.352 20 5 EIBDMO Cc1cc([C@@H]2CCC[N@@H+]2Cc2ccc(C(C)C)c([N+](=O)[O-])c2)on1 ZINC000509818480 1034050804 /nfs/dbraw/zinc/05/08/04/1034050804.db2.gz HQCJAPMWMVMUJA-INIZCTEOSA-N 1 1 329.400 4.352 20 5 EIBDMO COCc1ccc([C@H]2CCC[N@H+]2C/C=C/c2ccccc2[N+](=O)[O-])o1 ZINC000137077326 1034555785 /nfs/dbraw/zinc/55/57/85/1034555785.db2.gz IGMCNRLXJWSASR-WEBJUUICSA-N 1 1 342.395 4.185 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](c2nccs2)C1 ZINC000182726614 1034987237 /nfs/dbraw/zinc/98/72/37/1034987237.db2.gz XRCMJIABLYPHHC-KGLIPLIRSA-N 1 1 331.441 4.300 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccccc1OC(C)C ZINC000595016274 1035508171 /nfs/dbraw/zinc/50/81/71/1035508171.db2.gz JOZVOJZPVWYCGB-AWEZNQCLSA-N 1 1 344.411 4.241 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cccc(OC2CC2)c1F ZINC000595069012 1035551846 /nfs/dbraw/zinc/55/18/46/1035551846.db2.gz MGRADOOHFKAONB-CYBMUJFWSA-N 1 1 344.386 4.434 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)c1cccc(F)c1F ZINC000595035744 1035561518 /nfs/dbraw/zinc/56/15/18/1035561518.db2.gz LXQBHSBXRRHCEX-QWRGUYRKSA-N 1 1 336.338 4.293 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](C)c1cccc(F)c1F ZINC000595035742 1035562697 /nfs/dbraw/zinc/56/26/97/1035562697.db2.gz LXQBHSBXRRHCEX-GHMZBOCLSA-N 1 1 336.338 4.293 20 5 EIBDMO C[NH+](C)CC(C)(C)CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000237093566 1035580430 /nfs/dbraw/zinc/58/04/30/1035580430.db2.gz XBIZPYUHFHCNER-UHFFFAOYSA-N 1 1 347.484 4.001 20 5 EIBDMO CN(C)CC(C)(C)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000237093566 1035580447 /nfs/dbraw/zinc/58/04/47/1035580447.db2.gz XBIZPYUHFHCNER-UHFFFAOYSA-N 1 1 347.484 4.001 20 5 EIBDMO Cc1noc(C[N@H+]2CCC[C@H]2c2cccc3ccccc32)c1[N+](=O)[O-] ZINC000595295682 1035621700 /nfs/dbraw/zinc/62/17/00/1035621700.db2.gz OYBJRGMRRXDFOL-KRWDZBQOSA-N 1 1 337.379 4.382 20 5 EIBDMO Cc1noc(C[N@H+](C)[C@H](C)[C@H](C)c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000595334485 1035629730 /nfs/dbraw/zinc/62/97/30/1035629730.db2.gz QYBHFRFVRBCKES-CMPLNLGQSA-N 1 1 337.807 4.169 20 5 EIBDMO CCCc1ccc([C@@H]([NH2+]Cc2onc(C)c2[N+](=O)[O-])C(C)C)cc1 ZINC000595351478 1035663192 /nfs/dbraw/zinc/66/31/92/1035663192.db2.gz SQRRIKKWYQCNFS-KRWDZBQOSA-N 1 1 331.416 4.331 20 5 EIBDMO Cc1noc(C[NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)c1[N+](=O)[O-] ZINC000595416973 1035673303 /nfs/dbraw/zinc/67/33/03/1035673303.db2.gz WEDSJNGVAQPIDL-MRXNPFEDSA-N 1 1 333.363 4.051 20 5 EIBDMO Cc1noc(C[N@H+](C)[C@@H]2CCCC[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000595548485 1035704982 /nfs/dbraw/zinc/70/49/82/1035704982.db2.gz SNUMZCUFWUORBN-HZPDHXFCSA-N 1 1 329.400 4.049 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH2+]C2(c3ccc(C(F)(F)F)cc3)CC2)cs1 ZINC000593110969 1035774431 /nfs/dbraw/zinc/77/44/31/1035774431.db2.gz GIEQITVKYDZPNI-UHFFFAOYSA-N 1 1 342.342 4.454 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[NH2+]C1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000593110940 1035774883 /nfs/dbraw/zinc/77/48/83/1035774883.db2.gz FOQVFROXCPZUSI-UHFFFAOYSA-N 1 1 336.313 4.393 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H]([C@@H]2CCCCO2)C1 ZINC000595788863 1035791982 /nfs/dbraw/zinc/79/19/82/1035791982.db2.gz KGKPTHZTZVDFNS-PBHICJAKSA-N 1 1 338.835 4.029 20 5 EIBDMO CCOc1cc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000420939744 1035881902 /nfs/dbraw/zinc/88/19/02/1035881902.db2.gz CFTFBMISONKXGB-CYBMUJFWSA-N 1 1 346.349 4.158 20 5 EIBDMO COCc1csc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000597136943 1036116172 /nfs/dbraw/zinc/11/61/72/1036116172.db2.gz CQYFLCXWZDQTDM-INIZCTEOSA-N 1 1 346.452 4.182 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc2ncsc2c1 ZINC000485700631 1036197441 /nfs/dbraw/zinc/19/74/41/1036197441.db2.gz YUQICWFOJKREQT-SNVBAGLBSA-N 1 1 331.372 4.194 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccccc1N1CCCC1 ZINC000485893216 1036357664 /nfs/dbraw/zinc/35/76/64/1036357664.db2.gz GKHIRJPVPOOJRJ-INIZCTEOSA-N 1 1 339.439 4.388 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1N1CCCC1 ZINC000485893216 1036357684 /nfs/dbraw/zinc/35/76/84/1036357684.db2.gz GKHIRJPVPOOJRJ-INIZCTEOSA-N 1 1 339.439 4.388 20 5 EIBDMO C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000588982858 1036633250 /nfs/dbraw/zinc/63/32/50/1036633250.db2.gz HAGISDYTYLISSW-PHIMTYICSA-N 1 1 334.313 4.287 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000589200208 1036707453 /nfs/dbraw/zinc/70/74/53/1036707453.db2.gz WJKXSVIJKNQLJS-UEOVIOECSA-N 1 1 344.455 4.137 20 5 EIBDMO CCCCC[C@@H]1CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000486812301 1036861886 /nfs/dbraw/zinc/86/18/86/1036861886.db2.gz ZMHOOKXEILSRLI-OAHLLOKOSA-N 1 1 344.415 4.190 20 5 EIBDMO COc1ccc(C[N@@H+](C)Cc2cccc3ccccc32)cc1[N+](=O)[O-] ZINC000603850642 1037045198 /nfs/dbraw/zinc/04/51/98/1037045198.db2.gz OQFCQSMIRACMRF-UHFFFAOYSA-N 1 1 336.391 4.389 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@@H]2c2ccccc2C)cc1[N+](=O)[O-] ZINC000603857528 1037050051 /nfs/dbraw/zinc/05/00/51/1037050051.db2.gz WPFQDHXFXIJYTG-QGZVFWFLSA-N 1 1 326.396 4.249 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H](c3cc4ccccc4[nH]3)C2)c1 ZINC000603889904 1037076900 /nfs/dbraw/zinc/07/69/00/1037076900.db2.gz DJCRGRRDLNBVDQ-QGZVFWFLSA-N 1 1 335.407 4.456 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CC(CC(F)(F)F)C2)o1 ZINC000590969214 1037218230 /nfs/dbraw/zinc/21/82/30/1037218230.db2.gz NIPHSFLNEOJKJB-UHFFFAOYSA-N 1 1 340.301 4.239 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000604435664 1037390227 /nfs/dbraw/zinc/39/02/27/1037390227.db2.gz OGCNQGQXRWFBOU-VCBZYWHSSA-N 1 1 326.396 4.118 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000604435664 1037390242 /nfs/dbraw/zinc/39/02/42/1037390242.db2.gz OGCNQGQXRWFBOU-VCBZYWHSSA-N 1 1 326.396 4.118 20 5 EIBDMO COc1ccc2c(c1)CCC[C@H]2[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000604492779 1037407958 /nfs/dbraw/zinc/40/79/58/1037407958.db2.gz UNTNRYNVEQCMHO-HXUWFJFHSA-N 1 1 340.423 4.155 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)cc(Cl)c1N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000573277219 1037460075 /nfs/dbraw/zinc/46/00/75/1037460075.db2.gz MWORULOVTOABTQ-UHFFFAOYSA-N 1 1 341.198 4.009 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@]1(c2ccc(Cl)cc2)C[C@@H]1C ZINC000503373660 1037716777 /nfs/dbraw/zinc/71/67/77/1037716777.db2.gz XWNPZEUHXDQNSL-SGTLLEGYSA-N 1 1 346.814 4.282 20 5 EIBDMO C[C@@H]1C[C@@]1([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000503402614 1037737280 /nfs/dbraw/zinc/73/72/80/1037737280.db2.gz BKYFIFKCLIIPEL-DIFFPNOSSA-N 1 1 334.778 4.412 20 5 EIBDMO CCCC[N@H+](C)CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000489100267 1037863854 /nfs/dbraw/zinc/86/38/54/1037863854.db2.gz QARPMYFQYAZUAV-UHFFFAOYSA-N 1 1 347.484 4.145 20 5 EIBDMO CCCC[N@@H+](C)CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000489100267 1037863858 /nfs/dbraw/zinc/86/38/58/1037863858.db2.gz QARPMYFQYAZUAV-UHFFFAOYSA-N 1 1 347.484 4.145 20 5 EIBDMO COCC[C@H]([NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)c1ccco1 ZINC000503932492 1038020751 /nfs/dbraw/zinc/02/07/51/1038020751.db2.gz URPYJVCCBYLLLT-INIZCTEOSA-N 1 1 332.400 4.179 20 5 EIBDMO COc1ccccc1[C@@H]1CC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000490034223 1038312516 /nfs/dbraw/zinc/31/25/16/1038312516.db2.gz UQIDPZIJPIELFS-HZPDHXFCSA-N 1 1 340.423 4.462 20 5 EIBDMO C[C@@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1ccc([N+](=O)[O-])cc1 ZINC000594719293 1038392825 /nfs/dbraw/zinc/39/28/25/1038392825.db2.gz BRWWHTYJNFEECO-GFCCVEGCSA-N 1 1 330.359 4.126 20 5 EIBDMO COc1ccccc1[C@H]1CC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000075752946 1038421089 /nfs/dbraw/zinc/42/10/89/1038421089.db2.gz YHUMRHVHDNEODF-GJZGRUSLSA-N 1 1 326.396 4.154 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CC(c2nc3ccccc3s2)C1 ZINC000539142303 1038861312 /nfs/dbraw/zinc/86/13/12/1038861312.db2.gz KAAIHNPQMABWJF-LBPRGKRZSA-N 1 1 339.420 4.365 20 5 EIBDMO CSCC[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000537625487 1039037080 /nfs/dbraw/zinc/03/70/80/1039037080.db2.gz JIRMQNKAGCKREW-UHFFFAOYSA-N 1 1 340.832 4.303 20 5 EIBDMO C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000534121140 1039121006 /nfs/dbraw/zinc/12/10/06/1039121006.db2.gz JXACGSOSAOVDPI-UONOGXRCSA-N 1 1 329.400 4.260 20 5 EIBDMO COc1ccccc1[C@H]1CCCC[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000730062359 1039166168 /nfs/dbraw/zinc/16/61/68/1039166168.db2.gz MBGARROFNNCWKW-GOSISDBHSA-N 1 1 344.386 4.470 20 5 EIBDMO COc1ccccc1[C@H]1CCCC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000730062359 1039166178 /nfs/dbraw/zinc/16/61/78/1039166178.db2.gz MBGARROFNNCWKW-GOSISDBHSA-N 1 1 344.386 4.470 20 5 EIBDMO CCCCOc1ncccc1C[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000481422227 1039394639 /nfs/dbraw/zinc/39/46/39/1039394639.db2.gz KDYWJUJEULBBPY-SFHVURJKSA-N 1 1 343.427 4.410 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@H]2Cc2ccccc2C)cc1[N+](=O)[O-] ZINC000514184375 1039705221 /nfs/dbraw/zinc/70/52/21/1039705221.db2.gz TWVVOYADINOQBA-SFHVURJKSA-N 1 1 340.423 4.119 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1csc(Cl)c1 ZINC000191266397 1039887236 /nfs/dbraw/zinc/88/72/36/1039887236.db2.gz MSCKZDWOTTZAQM-VIFPVBQESA-N 1 1 326.805 4.169 20 5 EIBDMO C[C@H](c1cccc(Cl)c1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482704534 1040438974 /nfs/dbraw/zinc/43/89/74/1040438974.db2.gz KTESTNHEAVBFOS-LLVKDONJSA-N 1 1 344.802 4.318 20 5 EIBDMO C[C@H](c1cccc(Cl)c1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482704534 1040438984 /nfs/dbraw/zinc/43/89/84/1040438984.db2.gz KTESTNHEAVBFOS-LLVKDONJSA-N 1 1 344.802 4.318 20 5 EIBDMO C[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCc2ccccc21 ZINC000089884416 1040503991 /nfs/dbraw/zinc/50/39/91/1040503991.db2.gz ICQKGEGYGHQUNO-LJQANCHMSA-N 1 1 349.390 4.369 20 5 EIBDMO C[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCc2ccccc21 ZINC000089884416 1040504012 /nfs/dbraw/zinc/50/40/12/1040504012.db2.gz ICQKGEGYGHQUNO-LJQANCHMSA-N 1 1 349.390 4.369 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1c2ccc(F)cc2O[C@H]1C ZINC000554090300 1040774133 /nfs/dbraw/zinc/77/41/33/1040774133.db2.gz PRCLUTSHRCXFJC-OAVHHTNSSA-N 1 1 330.359 4.215 20 5 EIBDMO CC(C)CO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000537724984 1040776680 /nfs/dbraw/zinc/77/66/80/1040776680.db2.gz JLNFUKFGNWAOMX-QGZVFWFLSA-N 1 1 344.411 4.102 20 5 EIBDMO CCCCO[C@H]1C[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)C1(C)C ZINC001167960108 1040807299 /nfs/dbraw/zinc/80/72/99/1040807299.db2.gz SCCZYVQSLMTJLU-SJORKVTESA-N 1 1 338.423 4.150 20 5 EIBDMO CCC[C@H]([NH2+]Cc1nc2cc(C)ccc2[nH]1)c1cccc([N+](=O)[O-])c1 ZINC000483851506 1041052262 /nfs/dbraw/zinc/05/22/62/1041052262.db2.gz CSIFZUWJEQWCDF-INIZCTEOSA-N 1 1 338.411 4.411 20 5 EIBDMO CCC[C@H]([NH2+]Cc1nc2ccc(C)cc2[nH]1)c1cccc([N+](=O)[O-])c1 ZINC000483851506 1041052277 /nfs/dbraw/zinc/05/22/77/1041052277.db2.gz CSIFZUWJEQWCDF-INIZCTEOSA-N 1 1 338.411 4.411 20 5 EIBDMO CCC[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001167960834 1041260299 /nfs/dbraw/zinc/26/02/99/1041260299.db2.gz XAINOTYAJUDNHM-LBPRGKRZSA-N 1 1 341.249 4.369 20 5 EIBDMO CC[C@@]1(C)CCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000538736703 1041507887 /nfs/dbraw/zinc/50/78/87/1041507887.db2.gz XXKXDHZZEHNHMR-IBGZPJMESA-N 1 1 342.443 4.007 20 5 EIBDMO CC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC(C)(C)C ZINC000463371547 1041527617 /nfs/dbraw/zinc/52/76/17/1041527617.db2.gz QBOQYKUBCIMJSJ-UHFFFAOYSA-N 1 1 331.416 4.160 20 5 EIBDMO C[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1cn[nH]c1 ZINC000540619840 1041569884 /nfs/dbraw/zinc/56/98/84/1041569884.db2.gz RMKAJDAYIKQMFN-JTQLQIEISA-N 1 1 346.774 4.082 20 5 EIBDMO C[C@H]1CCC[C@@H]([N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000506178216 1042059624 /nfs/dbraw/zinc/05/96/24/1042059624.db2.gz IRDPFZZAMHZLDR-KBXCAEBGSA-N 1 1 342.443 4.006 20 5 EIBDMO COc1ccc(C[N@@H+]2C[C@H](C)C[C@@H]2c2ccccc2F)cc1[N+](=O)[O-] ZINC000464725680 1042142038 /nfs/dbraw/zinc/14/20/38/1042142038.db2.gz ORQVTGADNXZRMC-CXAGYDPISA-N 1 1 344.386 4.326 20 5 EIBDMO COc1ccc(C[N@H+]2C[C@H](C)C[C@@H]2c2ccccc2F)cc1[N+](=O)[O-] ZINC000464725680 1042142041 /nfs/dbraw/zinc/14/20/41/1042142041.db2.gz ORQVTGADNXZRMC-CXAGYDPISA-N 1 1 344.386 4.326 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@H](CSc2ccccc2)C1 ZINC000464760362 1042153339 /nfs/dbraw/zinc/15/33/39/1042153339.db2.gz GEWCYHOFBZIBBQ-AWEZNQCLSA-N 1 1 346.427 4.348 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@@H](CSc2ccccc2)C1 ZINC000464760363 1042153632 /nfs/dbraw/zinc/15/36/32/1042153632.db2.gz GEWCYHOFBZIBBQ-CQSZACIVSA-N 1 1 346.427 4.348 20 5 EIBDMO CC(C)[C@H](Cc1ccc(F)cc1)[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000464790967 1042169648 /nfs/dbraw/zinc/16/96/48/1042169648.db2.gz FKSKVMMXKWFXEU-INIZCTEOSA-N 1 1 336.432 4.495 20 5 EIBDMO C[C@H]1C[C@H]1c1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)o1 ZINC000030153147 1042491114 /nfs/dbraw/zinc/49/11/14/1042491114.db2.gz QHEUAUYDGBOIMK-SCLBCKFNSA-N 1 1 326.396 4.476 20 5 EIBDMO C[C@H]1C[C@H]1c1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)o1 ZINC000030153147 1042491117 /nfs/dbraw/zinc/49/11/17/1042491117.db2.gz QHEUAUYDGBOIMK-SCLBCKFNSA-N 1 1 326.396 4.476 20 5 EIBDMO Cc1c(C[N@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000484346773 1042615570 /nfs/dbraw/zinc/61/55/70/1042615570.db2.gz ZMHYPPVQELDQKH-CQSZACIVSA-N 1 1 330.350 4.314 20 5 EIBDMO C[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCS1 ZINC000426391428 1042634947 /nfs/dbraw/zinc/63/49/47/1042634947.db2.gz QWZAWUDEVANSRZ-CYBMUJFWSA-N 1 1 332.425 4.182 20 5 EIBDMO CC(C)([NH2+]Cc1ccccc1Br)c1ccccc1[N+](=O)[O-] ZINC000492436912 1042658541 /nfs/dbraw/zinc/65/85/41/1042658541.db2.gz HDNQACMLWAEOJF-UHFFFAOYSA-N 1 1 349.228 4.382 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCCC[C@H]3c3ccccc3)nc2c1 ZINC000439484466 1042661245 /nfs/dbraw/zinc/66/12/45/1042661245.db2.gz DVFKGVHLCGMLFY-SFHVURJKSA-N 1 1 336.395 4.198 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCCC[C@H]3c3ccccc3)nc2c1 ZINC000439484466 1042661254 /nfs/dbraw/zinc/66/12/54/1042661254.db2.gz DVFKGVHLCGMLFY-SFHVURJKSA-N 1 1 336.395 4.198 20 5 EIBDMO CC(C)(C)C[C@@H]1CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000141468063 1042873996 /nfs/dbraw/zinc/87/39/96/1042873996.db2.gz MEHAXFIXTMGIHW-HNNXBMFYSA-N 1 1 344.415 4.045 20 5 EIBDMO Cc1ccc2c(c1C)OC[C@@H]2[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761517610 1042875143 /nfs/dbraw/zinc/87/51/43/1042875143.db2.gz VIMJQZHRKNROBC-HNNXBMFYSA-N 1 1 332.787 4.088 20 5 EIBDMO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000507861473 1043160414 /nfs/dbraw/zinc/16/04/14/1043160414.db2.gz QKWZFKXBIRMOGP-MRXNPFEDSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1ccccc1[C@H]1CCC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000507861473 1043160422 /nfs/dbraw/zinc/16/04/22/1043160422.db2.gz QKWZFKXBIRMOGP-MRXNPFEDSA-N 1 1 330.359 4.080 20 5 EIBDMO CC(C)[N@@H+](C)Cc1ccccc1CNc1ncc(Cl)cc1[N+](=O)[O-] ZINC000301746961 1043308308 /nfs/dbraw/zinc/30/83/08/1043308308.db2.gz QMUBCKOGIHXYEW-UHFFFAOYSA-N 1 1 348.834 4.096 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCCCC2CCOCC2)C2CC2)cc1 ZINC000499598185 1043385819 /nfs/dbraw/zinc/38/58/19/1043385819.db2.gz FEQZAQOEJXXRGO-UHFFFAOYSA-N 1 1 332.444 4.156 20 5 EIBDMO CCC[N@@H+](Cc1ccc(F)cc1)Cc1cc([N+](=O)[O-])ccc1OC ZINC000521195662 1043644473 /nfs/dbraw/zinc/64/44/73/1043644473.db2.gz NCHGYOCJUSTNJL-UHFFFAOYSA-N 1 1 332.375 4.155 20 5 EIBDMO COCC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H](C)c1ccccc1 ZINC000521220911 1043656136 /nfs/dbraw/zinc/65/61/36/1043656136.db2.gz VKZAITMXFDDUOH-INIZCTEOSA-N 1 1 328.412 4.113 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2ccc(Cl)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000521383368 1043740993 /nfs/dbraw/zinc/74/09/93/1043740993.db2.gz JMNGYUAQOHZKDO-UHFFFAOYSA-N 1 1 346.814 4.421 20 5 EIBDMO COc1cc(Cl)ccc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429239406 1043842620 /nfs/dbraw/zinc/84/26/20/1043842620.db2.gz UALGFQYQCDWNMY-UHFFFAOYSA-N 1 1 334.803 4.282 20 5 EIBDMO Cn1c2ccc(Nc3ncc([N+](=O)[O-])cc3Cl)cc2[nH+]c1C1CC1 ZINC000301876830 1043878984 /nfs/dbraw/zinc/87/89/84/1043878984.db2.gz NINRKSPACVCWME-UHFFFAOYSA-N 1 1 343.774 4.151 20 5 EIBDMO CC[NH+](CC)Cc1cccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173331135 1043895194 /nfs/dbraw/zinc/89/51/94/1043895194.db2.gz CEUVSUNMERSTMH-INIZCTEOSA-N 1 1 341.455 4.287 20 5 EIBDMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000543247894 1044236333 /nfs/dbraw/zinc/23/63/33/1044236333.db2.gz ZBBBNNHVMVEGEX-CQSZACIVSA-N 1 1 329.400 4.118 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(F)c(Cl)c2)c(Cl)c1 ZINC000053157163 1044286732 /nfs/dbraw/zinc/28/67/32/1044286732.db2.gz WGYVQEQYASTDJR-UHFFFAOYSA-N 1 1 329.158 4.331 20 5 EIBDMO CC(C)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H](C)c1ccccc1 ZINC000428853307 1044720904 /nfs/dbraw/zinc/72/09/04/1044720904.db2.gz WNZJLUJRCNXNQA-CQSZACIVSA-N 1 1 338.411 4.443 20 5 EIBDMO CC(C)[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000428865825 1044774556 /nfs/dbraw/zinc/77/45/56/1044774556.db2.gz HJQMFAUVGFKQQT-HNNXBMFYSA-N 1 1 341.411 4.005 20 5 EIBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)cc1 ZINC000735490932 1044823699 /nfs/dbraw/zinc/82/36/99/1044823699.db2.gz WADYKRHVKKPNNT-CQSZACIVSA-N 1 1 346.814 4.246 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+](Cc2cccc(O)c2)CC2CC2)c1 ZINC000735490986 1044827269 /nfs/dbraw/zinc/82/72/69/1044827269.db2.gz YPMXUJOEXPWFSY-UHFFFAOYSA-N 1 1 346.814 4.366 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+](Cc2cccc(O)c2)CC2CC2)c1 ZINC000735490986 1044827272 /nfs/dbraw/zinc/82/72/72/1044827272.db2.gz YPMXUJOEXPWFSY-UHFFFAOYSA-N 1 1 346.814 4.366 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H](c2ccccn2)C2CC2)o1 ZINC000922585880 1044830745 /nfs/dbraw/zinc/83/07/45/1044830745.db2.gz HWNAIMYPTYHLKL-HXUWFJFHSA-N 1 1 349.390 4.491 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H](c3ccccn3)C3CC3)o2)cc1 ZINC000922586998 1044832003 /nfs/dbraw/zinc/83/20/03/1044832003.db2.gz VFYHLDSWJWJMLK-FQEVSTJZSA-N 1 1 349.390 4.491 20 5 EIBDMO COc1ccc([C@@H](C)[N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000735492096 1044832767 /nfs/dbraw/zinc/83/27/67/1044832767.db2.gz UMUSUKRPNBECFM-GFCCVEGCSA-N 1 1 334.803 4.450 20 5 EIBDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000735492096 1044832768 /nfs/dbraw/zinc/83/27/68/1044832768.db2.gz UMUSUKRPNBECFM-GFCCVEGCSA-N 1 1 334.803 4.450 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(N[C@@H]2C[N@H+](Cc3ccccc3)CC[C@H]2C)c1 ZINC000716233015 1044853400 /nfs/dbraw/zinc/85/34/00/1044853400.db2.gz TYZRNLKQBIXQFC-VQIMIIECSA-N 1 1 339.439 4.226 20 5 EIBDMO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccncc1)c1ccc([N+](=O)[O-])cc1 ZINC000156287229 1045034011 /nfs/dbraw/zinc/03/40/11/1045034011.db2.gz ZLQKAEKLURSYNT-YWZLYKJASA-N 1 1 333.391 4.430 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCCC4(CC4)C3)cs2)c1 ZINC000186622658 1045045051 /nfs/dbraw/zinc/04/50/51/1045045051.db2.gz YZZQFAOIDHRAMA-UHFFFAOYSA-N 1 1 329.425 4.094 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCCC4(CC4)C3)cs2)c1 ZINC000186622658 1045045065 /nfs/dbraw/zinc/04/50/65/1045045065.db2.gz YZZQFAOIDHRAMA-UHFFFAOYSA-N 1 1 329.425 4.094 20 5 EIBDMO COc1ccc(C[N@H+]2CCCC[C@@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000555735238 1045091730 /nfs/dbraw/zinc/09/17/30/1045091730.db2.gz HLMHEXAGFPLSCJ-GOSISDBHSA-N 1 1 340.423 4.201 20 5 EIBDMO C[C@H]1C[C@@H](Nc2sccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000302032192 1045156940 /nfs/dbraw/zinc/15/69/40/1045156940.db2.gz SMYYEOQBLLEENJ-ZFWWWQNUSA-N 1 1 331.441 4.121 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@H](c4ccco4)C3)o2)c1 ZINC000611271314 1045270665 /nfs/dbraw/zinc/27/06/65/1045270665.db2.gz PNPYNGGAGISSHQ-HNNXBMFYSA-N 1 1 338.363 4.437 20 5 EIBDMO Cc1cccc(C(C)(C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000611396306 1045300367 /nfs/dbraw/zinc/30/03/67/1045300367.db2.gz NKEVGDTYKYKKPX-UHFFFAOYSA-N 1 1 325.368 4.069 20 5 EIBDMO O=[N+]([O-])c1ccsc1NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000611411937 1045303595 /nfs/dbraw/zinc/30/35/95/1045303595.db2.gz HMRGSIINCJGGNI-MQVJKMGUSA-N 1 1 343.452 4.264 20 5 EIBDMO C[C@H]([NH2+]Cc1cocn1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000611474152 1045315270 /nfs/dbraw/zinc/31/52/70/1045315270.db2.gz IKILUBXVOYMCSZ-NSHDSACASA-N 1 1 329.381 4.162 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCSc2c(F)cccc21 ZINC000194155020 1045646281 /nfs/dbraw/zinc/64/62/81/1045646281.db2.gz CRZNHXHWKURZJM-HNNXBMFYSA-N 1 1 348.399 4.069 20 5 EIBDMO C[N@@H+](CC(=O)N1CCCC1)Cc1c2ccccc2cc2ccccc21 ZINC000768215365 1045755658 /nfs/dbraw/zinc/75/56/58/1045755658.db2.gz SZXKZEPYIGKURH-UHFFFAOYSA-N 1 1 332.447 4.047 20 5 EIBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000768548859 1045822792 /nfs/dbraw/zinc/82/27/92/1045822792.db2.gz ILAXJXXZGYKKJD-STQMWFEESA-N 1 1 328.865 4.354 20 5 EIBDMO C[C@H]1CCC[N@@H+](CCCCNc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000301121215 1045895748 /nfs/dbraw/zinc/89/57/48/1045895748.db2.gz WZCSVLRDITUBKI-HNNXBMFYSA-N 1 1 342.443 4.067 20 5 EIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1CCC2(CCCCCC2)O1 ZINC001170194378 1045933960 /nfs/dbraw/zinc/93/39/60/1045933960.db2.gz MKWPFHMWNPTNON-SFHVURJKSA-N 1 1 346.471 4.341 20 5 EIBDMO CC(C)[N@@H+](C)Cc1ccccc1CNc1cccc(F)c1[N+](=O)[O-] ZINC000301139147 1045946721 /nfs/dbraw/zinc/94/67/21/1045946721.db2.gz GEBDBJLAVGYOPK-UHFFFAOYSA-N 1 1 331.391 4.186 20 5 EIBDMO CC(C)[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C1CCC1 ZINC000769469586 1045984780 /nfs/dbraw/zinc/98/47/80/1045984780.db2.gz ANWQHDGIRRSVRS-UHFFFAOYSA-N 1 1 327.222 4.120 20 5 EIBDMO COc1ccc(C[C@@H](C)[N@@H+]2Cc3ccccc3[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC001170329599 1046001198 /nfs/dbraw/zinc/00/11/98/1046001198.db2.gz SBAYMLUSJUNZFY-LSDHHAIUSA-N 1 1 340.423 4.154 20 5 EIBDMO COc1ccc(C[C@H](C)[N@@H+](Cc2ccccc2)C2CC2)c([N+](=O)[O-])c1 ZINC001170353392 1046012100 /nfs/dbraw/zinc/01/21/00/1046012100.db2.gz XRAOUSIKHSFEEM-HNNXBMFYSA-N 1 1 340.423 4.199 20 5 EIBDMO COc1ccc(C[C@H](C)[N@@H+](C)Cc2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC001170346382 1046021672 /nfs/dbraw/zinc/02/16/72/1046021672.db2.gz NLLOVJXNIJFKLR-ZDUSSCGKSA-N 1 1 348.830 4.320 20 5 EIBDMO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000152468468 1046063434 /nfs/dbraw/zinc/06/34/34/1046063434.db2.gz OSACKKDAZWMALD-OAHLLOKOSA-N 1 1 331.441 4.123 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2c3ccccc3cc3ccccc32)C[C@]2(CCOC2)O1 ZINC000793362877 1046214701 /nfs/dbraw/zinc/21/47/01/1046214701.db2.gz OYVDDAGPTQSERQ-HXOBKFHXSA-N 1 1 347.458 4.373 20 5 EIBDMO C[C@H]1C[N@@H+](Cc2c3ccccc3cc3ccccc32)C[C@@]2(CCOC2)O1 ZINC000793362874 1046215073 /nfs/dbraw/zinc/21/50/73/1046215073.db2.gz OYVDDAGPTQSERQ-GAJHUEQPSA-N 1 1 347.458 4.373 20 5 EIBDMO C[C@]12CC[N@H+](C/C=C/c3ccccc3[N+](=O)[O-])C[C@H]1C2(Cl)Cl ZINC000793613441 1046311682 /nfs/dbraw/zinc/31/16/82/1046311682.db2.gz MOAZCZHOQPDHIU-WBNAFJIESA-N 1 1 341.238 4.124 20 5 EIBDMO C[C@]12CC[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])C[C@H]1C2(Cl)Cl ZINC000793613441 1046311698 /nfs/dbraw/zinc/31/16/98/1046311698.db2.gz MOAZCZHOQPDHIU-WBNAFJIESA-N 1 1 341.238 4.124 20 5 EIBDMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000536669398 1046618270 /nfs/dbraw/zinc/61/82/70/1046618270.db2.gz BBCSBTCDRCCQQG-IUODEOHRSA-N 1 1 331.441 4.339 20 5 EIBDMO C[C@@H](CCO)[N@@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000772380795 1046630829 /nfs/dbraw/zinc/63/08/29/1046630829.db2.gz DWYXOEUXYCXIOH-AWEZNQCLSA-N 1 1 348.830 4.021 20 5 EIBDMO C[C@@H](CCO)[N@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000772380795 1046630816 /nfs/dbraw/zinc/63/08/16/1046630816.db2.gz DWYXOEUXYCXIOH-AWEZNQCLSA-N 1 1 348.830 4.021 20 5 EIBDMO COc1ccc([C@H]2CC[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)cc1 ZINC000746667601 1046980363 /nfs/dbraw/zinc/98/03/63/1046980363.db2.gz ZBTICPFOSPMGEO-AWEZNQCLSA-N 1 1 346.814 4.246 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000787405583 1047006451 /nfs/dbraw/zinc/00/64/51/1047006451.db2.gz AFAHGEKKGMCPBY-UVTDQMKNSA-N 1 1 341.367 4.038 20 5 EIBDMO Cc1ccc(OCC[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000788460904 1047192956 /nfs/dbraw/zinc/19/29/56/1047192956.db2.gz AVKVAFZXYLZSBR-UHFFFAOYSA-N 1 1 334.803 4.067 20 5 EIBDMO Cc1ccc(OCC[N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000788460904 1047192966 /nfs/dbraw/zinc/19/29/66/1047192966.db2.gz AVKVAFZXYLZSBR-UHFFFAOYSA-N 1 1 334.803 4.067 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](CSc3ccccc3)C2)cc1F ZINC000788480030 1047199005 /nfs/dbraw/zinc/19/90/05/1047199005.db2.gz FYFRSSPQMQVIBA-HNNXBMFYSA-N 1 1 346.427 4.348 20 5 EIBDMO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788502219 1047208100 /nfs/dbraw/zinc/20/81/00/1047208100.db2.gz ICFNGNNWWXCHFS-JLTOFOAXSA-N 1 1 348.406 4.012 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+][C@@H]2COCc3cccc(Cl)c32)cc1[N+](=O)[O-] ZINC000788667302 1047268060 /nfs/dbraw/zinc/26/80/60/1047268060.db2.gz UPRQAQXXWCTFRZ-MLGOLLRUSA-N 1 1 346.814 4.479 20 5 EIBDMO CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000089512324 1047771857 /nfs/dbraw/zinc/77/18/57/1047771857.db2.gz IRUMGMUZSACBFA-GFCCVEGCSA-N 1 1 334.803 4.498 20 5 EIBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1OC(F)(F)F ZINC000089512408 1047788659 /nfs/dbraw/zinc/78/86/59/1047788659.db2.gz BUMMBGNQVVDTQH-NSHDSACASA-N 1 1 340.301 4.344 20 5 EIBDMO OC[C@H]1[C@@H]2C[N@@H+](Cc3c4ccccc4c(Cl)c4ccccc43)C[C@H]12 ZINC000814172240 1047866946 /nfs/dbraw/zinc/86/69/46/1047866946.db2.gz DVPRKXQRNHGOKO-PMOLBWCYSA-N 1 1 337.850 4.317 20 5 EIBDMO COCCNC1CC[NH+](Cc2c3ccccc3cc3ccccc32)CC1 ZINC000844899390 1048539632 /nfs/dbraw/zinc/53/96/32/1048539632.db2.gz AGDZIDWFDFELNU-UHFFFAOYSA-N 1 1 348.490 4.193 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](Oc2ccc(Cl)cc2)C1 ZINC001170594250 1048584700 /nfs/dbraw/zinc/58/47/00/1048584700.db2.gz RZVSYCIPXREJKA-XJKSGUPXSA-N 1 1 346.814 4.463 20 5 EIBDMO COC[C@H]1CCCC[N@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000809979160 1048587298 /nfs/dbraw/zinc/58/72/98/1048587298.db2.gz OTKDIKWUKVMTDP-NSHDSACASA-N 1 1 347.242 4.150 20 5 EIBDMO COC[C@H]1CCCC[N@@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000809979160 1048587318 /nfs/dbraw/zinc/58/73/18/1048587318.db2.gz OTKDIKWUKVMTDP-NSHDSACASA-N 1 1 347.242 4.150 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1F ZINC000064350391 1049052065 /nfs/dbraw/zinc/05/20/65/1049052065.db2.gz SWIRWBZAMZLLNK-UHFFFAOYSA-N 1 1 332.375 4.153 20 5 EIBDMO COc1ccc(C)cc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350279 1049052851 /nfs/dbraw/zinc/05/28/51/1049052851.db2.gz MLNPSQNVNDBFAJ-UHFFFAOYSA-N 1 1 328.412 4.322 20 5 EIBDMO COc1ccc(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])cc1 ZINC000811471904 1049094674 /nfs/dbraw/zinc/09/46/74/1049094674.db2.gz MPHZBENREAUAEX-UHFFFAOYSA-N 1 1 341.194 4.200 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@@H]1CCOC(C)(C)C1 ZINC000811511171 1049123446 /nfs/dbraw/zinc/12/34/46/1049123446.db2.gz DTFUIHZDUDHIAX-CYBMUJFWSA-N 1 1 326.824 4.028 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccccc2)CC2CCOCC2)cc1 ZINC000609540679 1049146609 /nfs/dbraw/zinc/14/66/09/1049146609.db2.gz APEXOJGMONXBOF-UHFFFAOYSA-N 1 1 340.423 4.024 20 5 EIBDMO COc1ccc(C[N@H+]2[C@H](C)C[C@@H](c3ccccc3)[C@@H]2C)cc1[N+](=O)[O-] ZINC001170638494 1049181611 /nfs/dbraw/zinc/18/16/11/1049181611.db2.gz JGHMKQBZRJTALB-RVKKMQEKSA-N 1 1 340.423 4.370 20 5 EIBDMO CCS[C@H]1CCCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000609705131 1049277244 /nfs/dbraw/zinc/27/72/44/1049277244.db2.gz SCWFOWPLZAHRGY-AWEZNQCLSA-N 1 1 328.865 4.356 20 5 EIBDMO Cc1ccc([C@@H]2CSCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000609706106 1049279859 /nfs/dbraw/zinc/27/98/59/1049279859.db2.gz XNZVCWFXJPGJCP-IBGZPJMESA-N 1 1 342.464 4.236 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000609916183 1049393747 /nfs/dbraw/zinc/39/37/47/1049393747.db2.gz DKVNTJKHNYSCQV-GOEBONIOSA-N 1 1 328.387 4.360 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2csc([N+](=O)[O-])c2)[C@@H](C)C2CC2)cc1 ZINC000064641554 1049399733 /nfs/dbraw/zinc/39/97/33/1049399733.db2.gz KMZQELRVKXFSHA-ZDUSSCGKSA-N 1 1 346.452 4.466 20 5 EIBDMO Cc1ccccc1[C@@H]1C[C@H](C)[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000610001879 1049468655 /nfs/dbraw/zinc/46/86/55/1049468655.db2.gz JKFCKLTXDCFMEE-LSDHHAIUSA-N 1 1 328.387 4.420 20 5 EIBDMO Cc1cn2cc(Nc3ccc(Br)cc3[N+](=O)[O-])ccc2[nH+]1 ZINC000610116359 1049538081 /nfs/dbraw/zinc/53/80/81/1049538081.db2.gz YAUROQYAXGWDGC-UHFFFAOYSA-N 1 1 347.172 4.057 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2CSCCc3ccccc32)c1 ZINC000773042774 1049545436 /nfs/dbraw/zinc/54/54/36/1049545436.db2.gz WUUPBYKBYQSGMD-KRWDZBQOSA-N 1 1 348.855 4.368 20 5 EIBDMO CCc1ccc([C@@H]2CC[N@@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)cc1 ZINC001170684208 1049545511 /nfs/dbraw/zinc/54/55/11/1049545511.db2.gz VUXOHSDSLZQTKG-MRXNPFEDSA-N 1 1 328.387 4.286 20 5 EIBDMO CC(C)[N@@H+](Cc1cn(C)nc1C(C)(C)C)Cc1ccc([N+](=O)[O-])cc1 ZINC000179696376 1049724516 /nfs/dbraw/zinc/72/45/16/1049724516.db2.gz YTTAPZIOMJVMKR-UHFFFAOYSA-N 1 1 344.459 4.036 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](Oc2ccccc2)C1 ZINC001171538549 1049735380 /nfs/dbraw/zinc/73/53/80/1049735380.db2.gz MOWJOZBKUMIJGY-YJBOKZPZSA-N 1 1 326.396 4.118 20 5 EIBDMO COc1cc(C[N@H+]2CCC[C@H]2CC2CCCC2)c([N+](=O)[O-])cc1F ZINC001171630680 1049762722 /nfs/dbraw/zinc/76/27/22/1049762722.db2.gz CYZLNTAQQBAMOE-HNNXBMFYSA-N 1 1 336.407 4.287 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCC[C@H]1c1ccncc1)CC2 ZINC001172915584 1050232194 /nfs/dbraw/zinc/23/21/94/1050232194.db2.gz PERJPAJYUCGKQJ-ICSRJNTNSA-N 1 1 337.423 4.074 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCc3ccc(F)cc3C1)CC2 ZINC001172914816 1050232273 /nfs/dbraw/zinc/23/22/73/1050232273.db2.gz JLGCVWJYVSAUKC-LJQANCHMSA-N 1 1 340.398 4.040 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCc3c(F)cccc3C1)CC2 ZINC001172920567 1050233625 /nfs/dbraw/zinc/23/36/25/1050233625.db2.gz KRNYUVKONAQCEJ-QGZVFWFLSA-N 1 1 340.398 4.040 20 5 EIBDMO CC(C)Oc1ccccc1[C@@H](C)[NH2+]Cc1cc(F)ccc1[N+](=O)[O-] ZINC000774983034 1050255217 /nfs/dbraw/zinc/25/52/17/1050255217.db2.gz UQECTAZYSAOULF-CYBMUJFWSA-N 1 1 332.375 4.372 20 5 EIBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNc1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC001186368206 1050301340 /nfs/dbraw/zinc/30/13/40/1050301340.db2.gz PAKDWZIRDHMMDT-AWEZNQCLSA-N 1 1 345.365 4.146 20 5 EIBDMO CCCC[N@@H+](CCC)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173188508 1050337727 /nfs/dbraw/zinc/33/77/27/1050337727.db2.gz GCFIWXQMUQMWHQ-ZDUSSCGKSA-N 1 1 326.412 4.186 20 5 EIBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CC[C@@H]2c2ccccc2)c1F ZINC001173196515 1050340409 /nfs/dbraw/zinc/34/04/09/1050340409.db2.gz NEFRFKAKRQPRGC-CZUORRHYSA-N 1 1 344.386 4.121 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C12CC3CC(CC(C3)C1)C2 ZINC001173225998 1050358113 /nfs/dbraw/zinc/35/81/13/1050358113.db2.gz GXBTZVZKMONODI-RRCMXIFQSA-N 1 1 328.456 4.426 20 5 EIBDMO COc1ccc([C@@H](C)[N@@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173234507 1050361772 /nfs/dbraw/zinc/36/17/72/1050361772.db2.gz RSPFFCBLXVFUCD-HUUCEWRRSA-N 1 1 328.412 4.227 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCc1ccccc1Cl ZINC001173233690 1050362169 /nfs/dbraw/zinc/36/21/69/1050362169.db2.gz MCLYMHQONVDLLM-CQSZACIVSA-N 1 1 332.831 4.354 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCc1ccccc1Cl ZINC001173233689 1050362362 /nfs/dbraw/zinc/36/23/62/1050362362.db2.gz MCLYMHQONVDLLM-AWEZNQCLSA-N 1 1 332.831 4.354 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCc2c(Cl)cccc2C1 ZINC001179862860 1050808529 /nfs/dbraw/zinc/80/85/29/1050808529.db2.gz DRPXDQDDVLEQPK-UHFFFAOYSA-N 1 1 330.815 4.423 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCc2c(Cl)cccc2C1 ZINC001179862860 1050808534 /nfs/dbraw/zinc/80/85/34/1050808534.db2.gz DRPXDQDDVLEQPK-UHFFFAOYSA-N 1 1 330.815 4.423 20 5 EIBDMO CS[C@@H]1CC[C@H]([N@@H+](C)Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001180071809 1050873279 /nfs/dbraw/zinc/87/32/79/1050873279.db2.gz IBFDUNNFCUQSNL-QWHCGFSZSA-N 1 1 348.390 4.330 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@H](COc2ccccc2)C1 ZINC001180318057 1050949400 /nfs/dbraw/zinc/94/94/00/1050949400.db2.gz VNMPHBGSRLGRTL-KRWDZBQOSA-N 1 1 340.423 4.113 20 5 EIBDMO CC1(C)CCC(C)(C)[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC001174725585 1051151833 /nfs/dbraw/zinc/15/18/33/1051151833.db2.gz PAIJFWHOBRIRAD-UHFFFAOYSA-N 1 1 344.415 4.045 20 5 EIBDMO CCCCC[C@@H]1CCCC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC001174780338 1051173005 /nfs/dbraw/zinc/17/30/05/1051173005.db2.gz OVFXZKULBCUVQE-MRXNPFEDSA-N 1 1 347.459 4.277 20 5 EIBDMO CC[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])[C@H](C)C(C)C ZINC001190606215 1051233459 /nfs/dbraw/zinc/23/34/59/1051233459.db2.gz SQTCINLHVYHNMU-LLVKDONJSA-N 1 1 329.238 4.224 20 5 EIBDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1C ZINC001190828012 1051286082 /nfs/dbraw/zinc/28/60/82/1051286082.db2.gz UEOBIDXSBVEZON-HNNXBMFYSA-N 1 1 328.412 4.413 20 5 EIBDMO C[C@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@H](c2ccco2)C1 ZINC001191212863 1051386839 /nfs/dbraw/zinc/38/68/39/1051386839.db2.gz DAAMLNLHMNCYKF-YJBOKZPZSA-N 1 1 344.411 4.430 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCc2cccc(Cl)c2C1 ZINC001182271891 1051452338 /nfs/dbraw/zinc/45/23/38/1051452338.db2.gz MDDGUOAVIMPVCN-UHFFFAOYSA-N 1 1 330.815 4.423 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCc2cccc(Cl)c2C1 ZINC001182271891 1051452345 /nfs/dbraw/zinc/45/23/45/1051452345.db2.gz MDDGUOAVIMPVCN-UHFFFAOYSA-N 1 1 330.815 4.423 20 5 EIBDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)C1(CC)CC ZINC001191822684 1051562251 /nfs/dbraw/zinc/56/22/51/1051562251.db2.gz YAYIOGAYBOULTI-IRXDYDNUSA-N 1 1 338.423 4.150 20 5 EIBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)CC(F)F ZINC001182965806 1051751766 /nfs/dbraw/zinc/75/17/66/1051751766.db2.gz AVYGBOJANYPRAV-UHFFFAOYSA-N 1 1 343.377 4.356 20 5 EIBDMO C[C@@]1(Cc2ccccc2)CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001193071621 1051862125 /nfs/dbraw/zinc/86/21/25/1051862125.db2.gz XQBVUDRKYKBKDE-FQEVSTJZSA-N 1 1 340.423 4.071 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCC[C@H]1c1ccccc1 ZINC001193055544 1051867305 /nfs/dbraw/zinc/86/73/05/1051867305.db2.gz XSJJLCMPNRXITI-SFHVURJKSA-N 1 1 326.396 4.331 20 5 EIBDMO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]2C ZINC001193271973 1051893929 /nfs/dbraw/zinc/89/39/29/1051893929.db2.gz CZQROORCQNJRSQ-KBPBESRZSA-N 1 1 326.396 4.111 20 5 EIBDMO COc1ccc2c(c1)C[C@H](C)[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]2C ZINC001193271973 1051893933 /nfs/dbraw/zinc/89/39/33/1051893933.db2.gz CZQROORCQNJRSQ-KBPBESRZSA-N 1 1 326.396 4.111 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccc(F)c2)C2CCC2)cc1F ZINC001176305065 1052008507 /nfs/dbraw/zinc/00/85/07/1052008507.db2.gz VZRJUXUMGVBLTR-UHFFFAOYSA-N 1 1 332.350 4.428 20 5 EIBDMO Cc1nc(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])sc1C(C)(C)C ZINC001194262213 1052118602 /nfs/dbraw/zinc/11/86/02/1052118602.db2.gz LCBSDGUVUSGNLV-UHFFFAOYSA-N 1 1 347.484 4.332 20 5 EIBDMO Cc1nc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])sc1C(C)(C)C ZINC001194262213 1052118615 /nfs/dbraw/zinc/11/86/15/1052118615.db2.gz LCBSDGUVUSGNLV-UHFFFAOYSA-N 1 1 347.484 4.332 20 5 EIBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H]2/C=C/c2ccccc2)cc1 ZINC001176641219 1052150295 /nfs/dbraw/zinc/15/02/95/1052150295.db2.gz QQRFPNBFCQOHIR-GFOMBABLSA-N 1 1 338.407 4.151 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3scnc3Cl)C2)cc1 ZINC001194476940 1052156477 /nfs/dbraw/zinc/15/64/77/1052156477.db2.gz FUHCDDUCPDPYIE-GFCCVEGCSA-N 1 1 337.832 4.084 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3scnc3Cl)C2)cc1 ZINC001194476940 1052156482 /nfs/dbraw/zinc/15/64/82/1052156482.db2.gz FUHCDDUCPDPYIE-GFCCVEGCSA-N 1 1 337.832 4.084 20 5 EIBDMO CC(C)c1ccc2c(c1)CC[N@H+](CCOc1cccc([N+](=O)[O-])c1)C2 ZINC001177027485 1052218774 /nfs/dbraw/zinc/21/87/74/1052218774.db2.gz LIMKOAWAQKLTTI-UHFFFAOYSA-N 1 1 340.423 4.155 20 5 EIBDMO CC(C)[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H](C)c1ccccc1 ZINC000794684113 1053267004 /nfs/dbraw/zinc/26/70/04/1053267004.db2.gz LJAJMNXZKOQRFI-HNAYVOBHSA-N 1 1 328.412 4.100 20 5 EIBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1CCCC[C@H]1c1ccccc1 ZINC001195156820 1053310142 /nfs/dbraw/zinc/31/01/42/1053310142.db2.gz ZORVMXAICLARRW-ROUUACIJSA-N 1 1 325.412 4.148 20 5 EIBDMO Cc1noc(C[NH2+][C@@H](c2ccccc2)C2CCCCC2)c1[N+](=O)[O-] ZINC000851885306 1053528310 /nfs/dbraw/zinc/52/83/10/1053528310.db2.gz ZBYNUPCKVKEQSF-KRWDZBQOSA-N 1 1 329.400 4.302 20 5 EIBDMO CC(C)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccccc1F ZINC000852449347 1053580713 /nfs/dbraw/zinc/58/07/13/1053580713.db2.gz TWJYSUQGDXAMNM-QGZVFWFLSA-N 1 1 347.346 4.129 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 ZINC001197844627 1054003483 /nfs/dbraw/zinc/00/34/83/1054003483.db2.gz LFIWLOBMIPZAGO-FZMZJTMJSA-N 1 1 348.752 4.413 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 ZINC001197844627 1054003492 /nfs/dbraw/zinc/00/34/92/1054003492.db2.gz LFIWLOBMIPZAGO-FZMZJTMJSA-N 1 1 348.752 4.413 20 5 EIBDMO C[N@H+]1CCC[C@H](CNc2cccc(F)c2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000301439316 1054166242 /nfs/dbraw/zinc/16/62/42/1054166242.db2.gz TVCWPBIXJZYKGN-MLGOLLRUSA-N 1 1 349.431 4.290 20 5 EIBDMO C[N@H+]1CCC[C@@H](CNc2cccc(F)c2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000301439314 1054169268 /nfs/dbraw/zinc/16/92/68/1054169268.db2.gz TVCWPBIXJZYKGN-BLLLJJGKSA-N 1 1 349.431 4.290 20 5 EIBDMO Cc1cccnc1[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC001198641608 1054214734 /nfs/dbraw/zinc/21/47/34/1054214734.db2.gz SRMZSMRNBYGGNF-LLVKDONJSA-N 1 1 339.317 4.168 20 5 EIBDMO COc1cccc2c1CC[C@H]2[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872043466 1054355989 /nfs/dbraw/zinc/35/59/89/1054355989.db2.gz ICCBIGXAMJCPKP-XHDPSFHLSA-N 1 1 330.359 4.081 20 5 EIBDMO COc1ccc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1Cl ZINC000872047981 1054361610 /nfs/dbraw/zinc/36/16/10/1054361610.db2.gz FQAIVAGWLGYUDA-SNVBAGLBSA-N 1 1 338.766 4.247 20 5 EIBDMO C[C@@H](N[C@@H](C)c1c(F)cccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000872060563 1054370835 /nfs/dbraw/zinc/37/08/35/1054370835.db2.gz RAVAHPHTKNTQMY-QLFBSQMISA-N 1 1 349.450 4.038 20 5 EIBDMO COCCc1cc[nH+]c(N[C@@H](C)c2cc([N+](=O)[O-])ccc2SC)c1 ZINC000872071656 1054378796 /nfs/dbraw/zinc/37/87/96/1054378796.db2.gz TWWOHNWPHKMPLX-LBPRGKRZSA-N 1 1 347.440 4.074 20 5 EIBDMO CC(C)c1ccc(CNC[C@@H](C)[N@@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC001199295592 1054382797 /nfs/dbraw/zinc/38/27/97/1054382797.db2.gz KJPQWRJEEUWTRV-HZPDHXFCSA-N 1 1 333.476 4.071 20 5 EIBDMO CC(C)c1ccc(CNC[C@@H](C)[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC001199295592 1054382802 /nfs/dbraw/zinc/38/28/02/1054382802.db2.gz KJPQWRJEEUWTRV-HZPDHXFCSA-N 1 1 333.476 4.071 20 5 EIBDMO CC(C)c1ccc(CNC[C@H](C)[N@@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC001199295591 1054383081 /nfs/dbraw/zinc/38/30/81/1054383081.db2.gz KJPQWRJEEUWTRV-HOTGVXAUSA-N 1 1 333.476 4.071 20 5 EIBDMO CC(C)c1ccc(CNC[C@H](C)[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC001199295591 1054383093 /nfs/dbraw/zinc/38/30/93/1054383093.db2.gz KJPQWRJEEUWTRV-HOTGVXAUSA-N 1 1 333.476 4.071 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000873046270 1054479630 /nfs/dbraw/zinc/47/96/30/1054479630.db2.gz OITXQHHHFIUKTP-UHFFFAOYSA-N 1 1 333.457 4.255 20 5 EIBDMO Cc1nn(C(C)(C)C)c(C)c1C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000877827824 1055130338 /nfs/dbraw/zinc/13/03/38/1055130338.db2.gz TZTVKYQVFFWDNY-LBPRGKRZSA-N 1 1 330.432 4.014 20 5 EIBDMO C[C@H](C1CCCCC1)[N@@H+](C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878566702 1055346460 /nfs/dbraw/zinc/34/64/60/1055346460.db2.gz MGJXVMUUOGLBEK-CYBMUJFWSA-N 1 1 344.415 4.045 20 5 EIBDMO C[C@H]1C[C@H](Nc2cccc(F)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000301508514 1055650119 /nfs/dbraw/zinc/65/01/19/1055650119.db2.gz AQBPSVXDGNISDJ-GOEBONIOSA-N 1 1 343.402 4.199 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1c(Cl)cccc1Cl ZINC000542703652 1055850287 /nfs/dbraw/zinc/85/02/87/1055850287.db2.gz SRWRSJAGXYVVIB-UHFFFAOYSA-N 1 1 325.195 4.500 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1c2ccc(F)cc2O[C@H]1C ZINC000554090301 1056008693 /nfs/dbraw/zinc/00/86/93/1056008693.db2.gz PRCLUTSHRCXFJC-PZROIBLQSA-N 1 1 330.359 4.215 20 5 EIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](C)C(C)(C)C1 ZINC000273705707 1056089077 /nfs/dbraw/zinc/08/90/77/1056089077.db2.gz NKYVNZOFKRNXKV-OLZOCXBDSA-N 1 1 344.415 4.074 20 5 EIBDMO C[C@H](NC[C@H](c1ccccc1)[NH+]1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000327258672 1056390757 /nfs/dbraw/zinc/39/07/57/1056390757.db2.gz CSUONEMHLXJKOR-OXJNMPFZSA-N 1 1 339.439 4.083 20 5 EIBDMO CC[N@@H+](Cc1ccc(Cl)cc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000746033264 1059975654 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332.787 4.036 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+]C1(c2ccc(Cl)cc2)CC1 ZINC000430212102 1019377778 /nfs/dbraw/zinc/37/77/78/1019377778.db2.gz ZIBHZMFFNMUHCH-UHFFFAOYSA-N 1 1 332.787 4.036 20 5 EIBDMO CC[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000120729557 1020104805 /nfs/dbraw/zinc/10/48/05/1020104805.db2.gz BMAZQIHIYWDVKD-BBRMVZONSA-N 1 1 344.415 4.045 20 5 EIBDMO C[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])s2)[C@H]1c1cccs1 ZINC000610281335 1020965685 /nfs/dbraw/zinc/96/56/85/1020965685.db2.gz QJBGYZQFGUKPKZ-NHYWBVRUSA-N 1 1 337.470 4.213 20 5 EIBDMO CC[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)[C@H](C)C(C)C ZINC000706425736 1021551128 /nfs/dbraw/zinc/55/11/28/1021551128.db2.gz RAHLFXFYPQQSJL-LLVKDONJSA-N 1 1 329.238 4.224 20 5 EIBDMO C[C@@H](NCC[C@@H](C)[N@@H+](C)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000379635503 1021846479 /nfs/dbraw/zinc/84/64/79/1021846479.db2.gz WFWVNABPEOQOKJ-IAGOWNOFSA-N 1 1 341.455 4.156 20 5 EIBDMO CC(C)c1ccc(C[NH2+][C@@H](c2ccccc2F)[C@@H](C)O)cc1[N+](=O)[O-] ZINC000582185600 1021931152 /nfs/dbraw/zinc/93/11/52/1021931152.db2.gz RWUBSJVUJHPIJY-BFUOFWGJSA-N 1 1 346.402 4.069 20 5 EIBDMO CCOc1cc(C[N@H+]2C[C@H](c3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC001167396951 1022005281 /nfs/dbraw/zinc/00/52/81/1022005281.db2.gz DCHWSUDNONGHOC-CRAIPNDOSA-N 1 1 340.423 4.372 20 5 EIBDMO C[C@@H](C1CC1)[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CC1 ZINC000549366781 1022088167 /nfs/dbraw/zinc/08/81/67/1022088167.db2.gz PZXXJLOGTAUZRA-JTQLQIEISA-N 1 1 328.334 4.377 20 5 EIBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1cnn(C2CCC2)c1 ZINC000925512469 1022302396 /nfs/dbraw/zinc/30/23/96/1022302396.db2.gz CRKISYICTCLDQO-LLVKDONJSA-N 1 1 334.807 4.021 20 5 EIBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@H]1CC[C@H](O)CC1 ZINC000275949011 1022450528 /nfs/dbraw/zinc/45/05/28/1022450528.db2.gz JEZSSFRRPMFOEK-KOMQPUFPSA-N 1 1 346.452 4.059 20 5 EIBDMO Cc1nc2ccccc2nc1C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178002181 1023209250 /nfs/dbraw/zinc/20/92/50/1023209250.db2.gz VHINURJYQMLDQC-UHFFFAOYSA-N 1 1 348.406 4.011 20 5 EIBDMO Cc1nc2ccccc2nc1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178002181 1023209268 /nfs/dbraw/zinc/20/92/68/1023209268.db2.gz VHINURJYQMLDQC-UHFFFAOYSA-N 1 1 348.406 4.011 20 5 EIBDMO CCc1nc(C)c(C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)o1 ZINC000417325991 1023267032 /nfs/dbraw/zinc/26/70/32/1023267032.db2.gz CQVPPGXIZXHMFN-MRXNPFEDSA-N 1 1 329.400 4.011 20 5 EIBDMO Cc1ccc(C[N@H+](C)Cn2c3cc([N+](=O)[O-])ccc3oc2=S)cc1 ZINC000023843038 1023271106 /nfs/dbraw/zinc/27/11/06/1023271106.db2.gz BVWFEDGMFFWZHF-UHFFFAOYSA-N 1 1 343.408 4.270 20 5 EIBDMO Cc1ccc(C[N@@H+](C)Cn2c3cc([N+](=O)[O-])ccc3oc2=S)cc1 ZINC000023843038 1023271115 /nfs/dbraw/zinc/27/11/15/1023271115.db2.gz BVWFEDGMFFWZHF-UHFFFAOYSA-N 1 1 343.408 4.270 20 5 EIBDMO COc1ccc2nc(C[NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3)sc2c1 ZINC000187419919 1023366635 /nfs/dbraw/zinc/36/66/35/1023366635.db2.gz WGLSBRRRCVSXKT-NSHDSACASA-N 1 1 343.408 4.064 20 5 EIBDMO C[N@H+](Cc1csc([N+](=O)[O-])c1)C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000051132229 1023472440 /nfs/dbraw/zinc/47/24/40/1023472440.db2.gz JVDCBKYWVGOWGK-FUHWJXTLSA-N 1 1 346.452 4.256 20 5 EIBDMO C[C@@H]([NH2+][C@@H](C)c1ccnn1CC1CCC1)c1ccccc1[N+](=O)[O-] ZINC000925690507 1023761230 /nfs/dbraw/zinc/76/12/30/1023761230.db2.gz GSGOGRQJMJHUDD-KGLIPLIRSA-N 1 1 328.416 4.003 20 5 EIBDMO C[C@@H]1C[C@]1([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc(Cl)cc1 ZINC000500395340 1023784809 /nfs/dbraw/zinc/78/48/09/1023784809.db2.gz GUEVSYMQQOCZEI-PIGZYNQJSA-N 1 1 334.778 4.412 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@H]4CCC[C@@H]43)cs2)c1 ZINC000511844092 1023932865 /nfs/dbraw/zinc/93/28/65/1023932865.db2.gz PLBDGVYXIGDJRZ-DYVFJYSZSA-N 1 1 343.452 4.483 20 5 EIBDMO CC1(C)CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000510525400 1023982361 /nfs/dbraw/zinc/98/23/61/1023982361.db2.gz UEQFPWSIUPPWEY-UHFFFAOYSA-N 1 1 331.441 4.340 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cc2ccccc2o1 ZINC000181763960 1024065618 /nfs/dbraw/zinc/06/56/18/1024065618.db2.gz NNPNJRABKITHQW-GFCCVEGCSA-N 1 1 326.352 4.200 20 5 EIBDMO Cc1cc(NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000065202071 1025149889 /nfs/dbraw/zinc/14/98/89/1025149889.db2.gz BEPNMHOTBOCMJL-SFHVURJKSA-N 1 1 339.439 4.227 20 5 EIBDMO CCc1ccc([C@@H](COC)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)o1 ZINC000165261542 1025180963 /nfs/dbraw/zinc/18/09/63/1025180963.db2.gz XXJQSQLZMRXCHM-CZUORRHYSA-N 1 1 332.400 4.097 20 5 EIBDMO Cc1ccc(C[N@@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)o1 ZINC000506790168 1025752103 /nfs/dbraw/zinc/75/21/03/1025752103.db2.gz OSHKGCJSWHDRNI-UHFFFAOYSA-N 1 1 326.352 4.388 20 5 EIBDMO Cc1ccc(C[N@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)o1 ZINC000506790168 1025752122 /nfs/dbraw/zinc/75/21/22/1025752122.db2.gz OSHKGCJSWHDRNI-UHFFFAOYSA-N 1 1 326.352 4.388 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccn(C2CCCC2)n1 ZINC000539063082 1025779383 /nfs/dbraw/zinc/77/93/83/1025779383.db2.gz QJKMCOLSBYQHRP-CQSZACIVSA-N 1 1 328.416 4.066 20 5 EIBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@H]1CCCOC1 ZINC000119719534 1025889208 /nfs/dbraw/zinc/88/92/08/1025889208.db2.gz IIHDKNQCJROCFE-CQSZACIVSA-N 1 1 346.452 4.182 20 5 EIBDMO C[N@@H+](CCCOc1cccc(Cl)c1)Cc1ccccc1[N+](=O)[O-] ZINC000071968567 1025934546 /nfs/dbraw/zinc/93/45/46/1025934546.db2.gz UBRGXTQQWPRVMI-UHFFFAOYSA-N 1 1 334.803 4.149 20 5 EIBDMO CC1(C)C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@H]2CCC[C@H]21 ZINC000550076126 1026019477 /nfs/dbraw/zinc/01/94/77/1026019477.db2.gz KWNOXLWFSJACMW-SJORKVTESA-N 1 1 341.411 4.260 20 5 EIBDMO Cc1ccc(C[NH2+]Cc2c(Cl)cccc2Cl)cc1[N+](=O)[O-] ZINC000604532646 1026488237 /nfs/dbraw/zinc/48/82/37/1026488237.db2.gz IZKJOJJPLKTTHN-UHFFFAOYSA-N 1 1 325.195 4.500 20 5 EIBDMO Cc1cc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c2ccccc2n1 ZINC000519587535 1026610167 /nfs/dbraw/zinc/61/01/67/1026610167.db2.gz CUFIRGFQLUJART-UHFFFAOYSA-N 1 1 335.407 4.126 20 5 EIBDMO C[N@@H+](CCC1CCCCC1)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000507617806 1026855246 /nfs/dbraw/zinc/85/52/46/1026855246.db2.gz OOOXDSXCYKEJTB-UHFFFAOYSA-N 1 1 344.415 4.047 20 5 EIBDMO COc1cc(C[N@@H+](C)C(C)C)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000158738790 1026948103 /nfs/dbraw/zinc/94/81/03/1026948103.db2.gz JEQIMGRPGAGRHX-UHFFFAOYSA-N 1 1 344.411 4.023 20 5 EIBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@]1(C)CC1(Cl)Cl ZINC001168042679 1027556988 /nfs/dbraw/zinc/55/69/88/1027556988.db2.gz GBTXRVJHOUTIQJ-GFCCVEGCSA-N 1 1 337.634 4.264 20 5 EIBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@]1(C)CC1(Cl)Cl ZINC001168042679 1027557007 /nfs/dbraw/zinc/55/70/07/1027557007.db2.gz GBTXRVJHOUTIQJ-GFCCVEGCSA-N 1 1 337.634 4.264 20 5 EIBDMO Cn1cc(C[N@@H+](C)[C@@H]2CCC(C)(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000475545295 1027598043 /nfs/dbraw/zinc/59/80/43/1027598043.db2.gz BCRKQRQEQNJEMZ-QGZVFWFLSA-N 1 1 342.443 4.006 20 5 EIBDMO CO[C@]1(C)CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000475577147 1027702498 /nfs/dbraw/zinc/70/24/98/1027702498.db2.gz ZNHBETHRVOJLAK-LJQANCHMSA-N 1 1 344.411 4.246 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc2ccccc2n1 ZINC000178730578 1027774359 /nfs/dbraw/zinc/77/43/59/1027774359.db2.gz SADKPYLBZYJXFA-ZDUSSCGKSA-N 1 1 337.379 4.002 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1sc(C(C)C)nc1C ZINC000178728636 1027774950 /nfs/dbraw/zinc/77/49/50/1027774950.db2.gz ZUAMBQMWVYDTEU-NSHDSACASA-N 1 1 349.456 4.343 20 5 EIBDMO Cc1cccc(N2CC[NH+]([C@H](C)c3ccccc3[N+](=O)[O-])CC2)c1C ZINC000439555432 1027898473 /nfs/dbraw/zinc/89/84/73/1027898473.db2.gz BXKKLRNFWDPIDI-QGZVFWFLSA-N 1 1 339.439 4.095 20 5 EIBDMO CC[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000444660187 1027931563 /nfs/dbraw/zinc/93/15/63/1027931563.db2.gz IXAQDPWKZIFWKZ-BBRMVZONSA-N 1 1 344.415 4.045 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccccc2)CC2CCOCC2)c1 ZINC000523610498 1028261480 /nfs/dbraw/zinc/26/14/80/1028261480.db2.gz YRYBAFDEZQFHKM-UHFFFAOYSA-N 1 1 340.423 4.024 20 5 EIBDMO Cc1cc(C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc2cccnc12 ZINC000346191464 1028318067 /nfs/dbraw/zinc/31/80/67/1028318067.db2.gz CEDRJKPTTTZFFW-UHFFFAOYSA-N 1 1 333.391 4.010 20 5 EIBDMO Cc1cc(C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc2cccnc12 ZINC000346191464 1028318076 /nfs/dbraw/zinc/31/80/76/1028318076.db2.gz CEDRJKPTTTZFFW-UHFFFAOYSA-N 1 1 333.391 4.010 20 5 EIBDMO CC(C)CCOC1CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000523857353 1028443940 /nfs/dbraw/zinc/44/39/40/1028443940.db2.gz RWPYFBKGOKEWSO-UHFFFAOYSA-N 1 1 340.851 4.275 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H](c2cncc(F)c2)C2CC2)c1 ZINC000281789398 1028871951 /nfs/dbraw/zinc/87/19/51/1028871951.db2.gz XQRDZTRLOBEPNP-INIZCTEOSA-N 1 1 335.766 4.023 20 5 EIBDMO COCC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@H](C)c1ccccc1 ZINC000508560004 1029266234 /nfs/dbraw/zinc/26/62/34/1029266234.db2.gz HOMRYSRUGHCWAR-MRXNPFEDSA-N 1 1 328.412 4.113 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](C(F)(F)F)[C@@H]1C ZINC000475281496 1029496001 /nfs/dbraw/zinc/49/60/01/1029496001.db2.gz PNBGXSSKBMLFIJ-FMUZQAFBSA-N 1 1 328.334 4.271 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](C(F)(F)F)[C@@H]1C ZINC000475281499 1029496551 /nfs/dbraw/zinc/49/65/51/1029496551.db2.gz PNBGXSSKBMLFIJ-LFIVMHCDSA-N 1 1 328.334 4.271 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@@H]4CCC[C@H]43)cs2)c1 ZINC000428451744 1029534650 /nfs/dbraw/zinc/53/46/50/1029534650.db2.gz FKKQQIOKMKOKLE-BLLLJJGKSA-N 1 1 329.425 4.093 20 5 EIBDMO COc1cc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)ccc1C ZINC000447797476 1030327886 /nfs/dbraw/zinc/32/78/86/1030327886.db2.gz KGXSLHFPWRFQSV-UHFFFAOYSA-N 1 1 326.396 4.076 20 5 EIBDMO CC(C)[N@@H+](Cc1c[nH]nc1C(C)(C)C)Cc1ccc([N+](=O)[O-])cc1 ZINC000179320468 1030898688 /nfs/dbraw/zinc/89/86/88/1030898688.db2.gz ZOPBPZOMRBQFPF-UHFFFAOYSA-N 1 1 330.432 4.026 20 5 EIBDMO Cc1ncsc1C[N@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000179427951 1031060538 /nfs/dbraw/zinc/06/05/38/1031060538.db2.gz DSMQGFGZMOYPKP-UHFFFAOYSA-N 1 1 343.408 4.252 20 5 EIBDMO Cc1ncsc1C[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000179427951 1031060557 /nfs/dbraw/zinc/06/05/57/1031060557.db2.gz DSMQGFGZMOYPKP-UHFFFAOYSA-N 1 1 343.408 4.252 20 5 EIBDMO CCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H](C)c1cc2ccccc2o1 ZINC000472433135 1031572284 /nfs/dbraw/zinc/57/22/84/1031572284.db2.gz NGQFZOJKZUNMJV-AWEZNQCLSA-N 1 1 342.399 4.011 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3scnc3C3CC3)C2)cc1 ZINC000449499362 1031807928 /nfs/dbraw/zinc/80/79/28/1031807928.db2.gz LXAZLYQONDEGSM-OAHLLOKOSA-N 1 1 343.452 4.308 20 5 EIBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1(C)C ZINC000449506984 1031814084 /nfs/dbraw/zinc/81/40/84/1031814084.db2.gz ZXSGDYVUDMUZNV-SFHVURJKSA-N 1 1 344.411 4.102 20 5 EIBDMO COc1cccc([C@H]2C[C@H]([N@H+](C)Cc3csc([N+](=O)[O-])c3)C2)c1 ZINC000449753374 1031986922 /nfs/dbraw/zinc/98/69/22/1031986922.db2.gz GEBJVJOFIBHARE-SHTZXODSSA-N 1 1 332.425 4.043 20 5 EIBDMO COc1cccc([C@H]2C[C@H]([N@@H+](C)Cc3csc([N+](=O)[O-])c3)C2)c1 ZINC000449753374 1031986933 /nfs/dbraw/zinc/98/69/33/1031986933.db2.gz GEBJVJOFIBHARE-SHTZXODSSA-N 1 1 332.425 4.043 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](CC(=O)OC(C)(C)C)C1 ZINC000532127305 1032055808 /nfs/dbraw/zinc/05/58/08/1032055808.db2.gz RYFAFPJRDBJDHZ-GJZGRUSLSA-N 1 1 348.443 4.100 20 5 EIBDMO COC[C@@H]([NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccc(C)o1 ZINC000433293331 1034185314 /nfs/dbraw/zinc/18/53/14/1034185314.db2.gz DNCDXMKXUHZJMC-IAGOWNOFSA-N 1 1 344.411 4.196 20 5 EIBDMO CC(C)CC[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CCCC1 ZINC000508821929 1034292716 /nfs/dbraw/zinc/29/27/16/1034292716.db2.gz KDWARSJEFRMDFY-UHFFFAOYSA-N 1 1 348.443 4.252 20 5 EIBDMO COc1ccccc1C[C@H](C)[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000513479525 1034979968 /nfs/dbraw/zinc/97/99/68/1034979968.db2.gz NGHQYBGJZHLMKB-CLOOOTJHSA-N 1 1 340.423 4.180 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](c2nccs2)C1 ZINC000182726639 1034986551 /nfs/dbraw/zinc/98/65/51/1034986551.db2.gz XRCMJIABLYPHHC-KBPBESRZSA-N 1 1 331.441 4.300 20 5 EIBDMO Cc1nn(C)c(C)c1[C@H]1CCC[N@@H+]1[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182759360 1034988972 /nfs/dbraw/zinc/98/89/72/1034988972.db2.gz TZTUQCMZKUJFAI-KBXCAEBGSA-N 1 1 342.443 4.152 20 5 EIBDMO C[C@@H](NCc1ccc(C[NH+]2CCCC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000182818041 1034994744 /nfs/dbraw/zinc/99/47/44/1034994744.db2.gz VMULRQJLHBTDEW-MRXNPFEDSA-N 1 1 339.439 4.041 20 5 EIBDMO CCC[N@H+](Cc1c([N+](=O)[O-])ncn1C)[C@@H](C)c1cc2ccccc2o1 ZINC000355545043 1035422058 /nfs/dbraw/zinc/42/20/58/1035422058.db2.gz NSTBSKBXGDWQGL-ZDUSSCGKSA-N 1 1 342.399 4.048 20 5 EIBDMO CCC[N@@H+](Cc1c([N+](=O)[O-])ncn1C)[C@@H](C)c1cc2ccccc2o1 ZINC000355545043 1035422067 /nfs/dbraw/zinc/42/20/67/1035422067.db2.gz NSTBSKBXGDWQGL-ZDUSSCGKSA-N 1 1 342.399 4.048 20 5 EIBDMO CSc1ccccc1[C@@H](C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000501550369 1035460849 /nfs/dbraw/zinc/46/08/49/1035460849.db2.gz KKMQZAWXBHLDBN-LLVKDONJSA-N 1 1 343.408 4.309 20 5 EIBDMO CC(C)[C@H](O)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000594988660 1035517926 /nfs/dbraw/zinc/51/79/26/1035517926.db2.gz ASINDYXDXWQIEJ-MSOLQXFVSA-N 1 1 348.830 4.096 20 5 EIBDMO COc1ccc([C@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1F ZINC000595002926 1035525008 /nfs/dbraw/zinc/52/50/08/1035525008.db2.gz BQVOTKVWWUHVFC-NWDGAFQWSA-N 1 1 348.374 4.163 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CCCOc2ccccc21 ZINC000595036693 1035562327 /nfs/dbraw/zinc/56/23/27/1035562327.db2.gz KMSWWIJSASKVBD-SUMWQHHRSA-N 1 1 342.395 4.168 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)c1cccc(F)c1F ZINC000595035745 1035562434 /nfs/dbraw/zinc/56/24/34/1035562434.db2.gz LXQBHSBXRRHCEX-WDEREUQCSA-N 1 1 336.338 4.293 20 5 EIBDMO CCC[C@H]([NH2+]Cc1c(OC)cccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000595075787 1035592305 /nfs/dbraw/zinc/59/23/05/1035592305.db2.gz YUYQNUJNXUIIRL-KRWDZBQOSA-N 1 1 344.411 4.243 20 5 EIBDMO Cc1noc(C[N@@H+](CCc2ccc(F)cc2)C2CCCC2)c1[N+](=O)[O-] ZINC000595296925 1035626578 /nfs/dbraw/zinc/62/65/78/1035626578.db2.gz ODXRAJSPORMDII-UHFFFAOYSA-N 1 1 347.390 4.018 20 5 EIBDMO Cc1noc(C[N@@H+](CC2CCC2)[C@@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000595330502 1035630488 /nfs/dbraw/zinc/63/04/88/1035630488.db2.gz LQRZJYOZLSTHQJ-AWEZNQCLSA-N 1 1 329.400 4.255 20 5 EIBDMO Cc1noc(C[N@H+](CC2CCC2)[C@@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000595330502 1035630519 /nfs/dbraw/zinc/63/05/19/1035630519.db2.gz LQRZJYOZLSTHQJ-AWEZNQCLSA-N 1 1 329.400 4.255 20 5 EIBDMO Cc1noc(C[N@@H+](CC2CCC2)[C@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000595330503 1035632723 /nfs/dbraw/zinc/63/27/23/1035632723.db2.gz LQRZJYOZLSTHQJ-CQSZACIVSA-N 1 1 329.400 4.255 20 5 EIBDMO Cc1noc(C[N@H+](CC2CCC2)[C@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000595330503 1035632765 /nfs/dbraw/zinc/63/27/65/1035632765.db2.gz LQRZJYOZLSTHQJ-CQSZACIVSA-N 1 1 329.400 4.255 20 5 EIBDMO CCOc1ccccc1[C@H](CC)[NH2+]Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595412887 1035673353 /nfs/dbraw/zinc/67/33/53/1035673353.db2.gz NYZAWRWLXRXOFE-INIZCTEOSA-N 1 1 332.375 4.374 20 5 EIBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1csc2ccccc12 ZINC000502060237 1035821665 /nfs/dbraw/zinc/82/16/65/1035821665.db2.gz DLXUQWLFKVJNPK-UHFFFAOYSA-N 1 1 342.420 4.320 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)CCCC(=O)OC(C)(C)C ZINC000485458933 1035893197 /nfs/dbraw/zinc/89/31/97/1035893197.db2.gz SQYOQXKMVLJHOR-AWEZNQCLSA-N 1 1 336.432 4.018 20 5 EIBDMO Cc1cc(CNc2ccc([N+](=O)[O-])cc2Cl)cc(N2CCCC2)[nH+]1 ZINC000571035421 1035907398 /nfs/dbraw/zinc/90/73/98/1035907398.db2.gz NVBORGQSIBCORV-UHFFFAOYSA-N 1 1 346.818 4.164 20 5 EIBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)CC1=CCCOC1 ZINC000597205448 1036161476 /nfs/dbraw/zinc/16/14/76/1036161476.db2.gz FOKBDPOZOPRIQX-UHFFFAOYSA-N 1 1 344.436 4.102 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCCN(c2ccccc2)CC1 ZINC000485745247 1036237494 /nfs/dbraw/zinc/23/74/94/1036237494.db2.gz PDMYGPNNTLXQMT-QGZVFWFLSA-N 1 1 339.439 4.177 20 5 EIBDMO COc1cc(C[N@@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc(OC)c1 ZINC000485819206 1036301177 /nfs/dbraw/zinc/30/11/77/1036301177.db2.gz AOJABAKQAKIKRK-CQSZACIVSA-N 1 1 344.411 4.113 20 5 EIBDMO CCOC1(C)CC[NH+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000293736959 1036440928 /nfs/dbraw/zinc/44/09/28/1036440928.db2.gz ZTQFYDLRSQFNTJ-UHFFFAOYSA-N 1 1 346.349 4.005 20 5 EIBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc(C(F)F)nc1 ZINC000602438024 1036449259 /nfs/dbraw/zinc/44/92/59/1036449259.db2.gz AEXILDHFXIQDRB-UHFFFAOYSA-N 1 1 335.354 4.338 20 5 EIBDMO C[C@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)c1ccsc1 ZINC000602659150 1036556145 /nfs/dbraw/zinc/55/61/45/1036556145.db2.gz OLHOPVHOPZFJSC-ZETCQYMHSA-N 1 1 347.259 4.331 20 5 EIBDMO Cc1ccccc1C(C)(C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602677506 1036566023 /nfs/dbraw/zinc/56/60/23/1036566023.db2.gz VQXWPZOTZZTLLV-UHFFFAOYSA-N 1 1 325.368 4.069 20 5 EIBDMO CCC[C@H](C)[C@H]1CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000486802295 1036865279 /nfs/dbraw/zinc/86/52/79/1036865279.db2.gz WUWIAQGUIYBLLD-XJKSGUPXSA-N 1 1 344.415 4.045 20 5 EIBDMO Cc1cnc(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)s1 ZINC000174573736 1036989573 /nfs/dbraw/zinc/98/95/73/1036989573.db2.gz VLGBIVGXHOWBIE-UHFFFAOYSA-N 1 1 345.449 4.378 20 5 EIBDMO Cc1c(C[NH2+]Cc2c(Cl)cccc2Cl)cccc1[N+](=O)[O-] ZINC000231883729 1037008643 /nfs/dbraw/zinc/00/86/43/1037008643.db2.gz RMTURABUMFFOCF-UHFFFAOYSA-N 1 1 325.195 4.500 20 5 EIBDMO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000603836968 1037020264 /nfs/dbraw/zinc/02/02/64/1037020264.db2.gz FZCHAIFLTDECAL-AWEZNQCLSA-N 1 1 340.379 4.413 20 5 EIBDMO Cc1c(C[N@@H+]2CC=C(c3ccc(F)cc3)CC2)cccc1[N+](=O)[O-] ZINC000603838653 1037020421 /nfs/dbraw/zinc/02/04/21/1037020421.db2.gz DTUWLBAYRNFPBF-UHFFFAOYSA-N 1 1 326.371 4.332 20 5 EIBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(C(F)(F)F)cc1 ZINC000603842017 1037034437 /nfs/dbraw/zinc/03/44/37/1037034437.db2.gz ASJVCMIQUWGNBQ-UHFFFAOYSA-N 1 1 338.329 4.288 20 5 EIBDMO C[C@@H](c1ccccc1Cl)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000603856674 1037049124 /nfs/dbraw/zinc/04/91/24/1037049124.db2.gz RLJLMGSFTIQSCN-ZDUSSCGKSA-N 1 1 334.803 4.320 20 5 EIBDMO C[C@H](c1ccccc1F)[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000604013584 1037147989 /nfs/dbraw/zinc/14/79/89/1037147989.db2.gz RCVUEZSDRCSKQZ-CQSZACIVSA-N 1 1 332.375 4.196 20 5 EIBDMO C[C@H]1CSCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000488400436 1037566073 /nfs/dbraw/zinc/56/60/73/1037566073.db2.gz TUJFUWWRUVGEIX-CYBMUJFWSA-N 1 1 332.425 4.040 20 5 EIBDMO Cc1ccncc1CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000570152511 1037575280 /nfs/dbraw/zinc/57/52/80/1037575280.db2.gz VSFLYEPJEYHOCA-UHFFFAOYSA-N 1 1 327.428 4.141 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](Nc2ccccc2)C1 ZINC000489975399 1038293794 /nfs/dbraw/zinc/29/37/94/1038293794.db2.gz DFXYMEBPFGTKIG-WBVHZDCISA-N 1 1 325.412 4.151 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](Nc2ccccc2)C1 ZINC000489975397 1038294679 /nfs/dbraw/zinc/29/46/79/1038294679.db2.gz DFXYMEBPFGTKIG-RDJZCZTQSA-N 1 1 325.412 4.151 20 5 EIBDMO CCC[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])CC1CCCCC1 ZINC000063558984 1038436477 /nfs/dbraw/zinc/43/64/77/1038436477.db2.gz DCXFAHPDMAAUAE-UHFFFAOYSA-N 1 1 347.459 4.134 20 5 EIBDMO C[N@H+](Cc1ccccc1)CC1CCN(c2ccc([N+](=O)[O-])s2)CC1 ZINC000608974192 1038985511 /nfs/dbraw/zinc/98/55/11/1038985511.db2.gz YLGHYZZSALBKQV-UHFFFAOYSA-N 1 1 345.468 4.005 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@@H](c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000608977638 1038987693 /nfs/dbraw/zinc/98/76/93/1038987693.db2.gz XBCONIPBDXNNOF-GOSISDBHSA-N 1 1 340.423 4.373 20 5 EIBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCCCC[C@H]2c2ccc(Cl)cc2)n1 ZINC000478051594 1039374415 /nfs/dbraw/zinc/37/44/15/1039374415.db2.gz BVGXBLDWRNOIGP-INIZCTEOSA-N 1 1 348.834 4.062 20 5 EIBDMO CCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](C)c1cc2ccccc2o1 ZINC000478409259 1039738359 /nfs/dbraw/zinc/73/83/59/1039738359.db2.gz XXKMNBVEFMXHRA-AWEZNQCLSA-N 1 1 342.399 4.011 20 5 EIBDMO CC(C)([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccccc1 ZINC000534857038 1039827985 /nfs/dbraw/zinc/82/79/85/1039827985.db2.gz CJYNVTDEPUSBAN-UHFFFAOYSA-N 1 1 337.379 4.275 20 5 EIBDMO C[C@@H]([NH2+][C@@H](C)CCN(C)C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000481951762 1039908584 /nfs/dbraw/zinc/90/85/84/1039908584.db2.gz HFZMTAVWVDUGJS-UONOGXRCSA-N 1 1 347.484 4.314 20 5 EIBDMO C[C@@H](N[C@@H](C)CC[NH+](C)C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000481951762 1039908603 /nfs/dbraw/zinc/90/86/03/1039908603.db2.gz HFZMTAVWVDUGJS-UONOGXRCSA-N 1 1 347.484 4.314 20 5 EIBDMO C[C@H](CCN(C)C)[NH2+][C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000481951763 1039909620 /nfs/dbraw/zinc/90/96/20/1039909620.db2.gz HFZMTAVWVDUGJS-ZIAGYGMSSA-N 1 1 347.484 4.314 20 5 EIBDMO C[C@H](CC[NH+](C)C)N[C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000481951763 1039909642 /nfs/dbraw/zinc/90/96/42/1039909642.db2.gz HFZMTAVWVDUGJS-ZIAGYGMSSA-N 1 1 347.484 4.314 20 5 EIBDMO Cc1ccoc1C[N@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000430133767 1040122924 /nfs/dbraw/zinc/12/29/24/1040122924.db2.gz QGGIECHEAPDESM-UHFFFAOYSA-N 1 1 326.352 4.388 20 5 EIBDMO Cc1ccoc1C[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000430133767 1040122941 /nfs/dbraw/zinc/12/29/41/1040122941.db2.gz QGGIECHEAPDESM-UHFFFAOYSA-N 1 1 326.352 4.388 20 5 EIBDMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000482497110 1040292035 /nfs/dbraw/zinc/29/20/35/1040292035.db2.gz YMCYORPMORZZDG-WBMJQRKESA-N 1 1 331.441 4.339 20 5 EIBDMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000482497107 1040293004 /nfs/dbraw/zinc/29/30/04/1040293004.db2.gz YMCYORPMORZZDG-BLLLJJGKSA-N 1 1 331.441 4.339 20 5 EIBDMO CCC[C@H]([NH2+]Cc1cn2ccc(C)cc2n1)c1cccc([N+](=O)[O-])c1 ZINC000482516985 1040313645 /nfs/dbraw/zinc/31/36/45/1040313645.db2.gz YRFLGLIHVZIDBM-SFHVURJKSA-N 1 1 338.411 4.182 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+](C3CC3)C3CCCC3)co2)cc1 ZINC000089896792 1040516643 /nfs/dbraw/zinc/51/66/43/1040516643.db2.gz ZSCCIIFSBMOLOK-UHFFFAOYSA-N 1 1 327.384 4.157 20 5 EIBDMO C[C@H](c1ccsc1)[NH+]1CCN([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000462454439 1040620244 /nfs/dbraw/zinc/62/02/44/1040620244.db2.gz HALGVZJFZXRPNR-LSDHHAIUSA-N 1 1 345.468 4.096 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2cccc(OC3CC3)c2F)cc1[N+](=O)[O-] ZINC000594942817 1040675094 /nfs/dbraw/zinc/67/50/94/1040675094.db2.gz ZRUIEPRQPNADSP-CYBMUJFWSA-N 1 1 344.386 4.434 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](c1ncccc1C)C(C)C ZINC000595007723 1040741209 /nfs/dbraw/zinc/74/12/09/1040741209.db2.gz IXMKGUQPHQNQCL-RDTXWAMCSA-N 1 1 343.427 4.355 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000539807242 1040802915 /nfs/dbraw/zinc/80/29/15/1040802915.db2.gz ZGTDWBAKZDITBS-OCCSQVGLSA-N 1 1 346.349 4.008 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000539807242 1040802920 /nfs/dbraw/zinc/80/29/20/1040802920.db2.gz ZGTDWBAKZDITBS-OCCSQVGLSA-N 1 1 346.349 4.008 20 5 EIBDMO COc1ccc(C[N@@H+](C)Cc2ccc(C(C)C)cc2)cc1[N+](=O)[O-] ZINC000515540263 1040842098 /nfs/dbraw/zinc/84/20/98/1040842098.db2.gz SXBHMGJVNPZYTR-UHFFFAOYSA-N 1 1 328.412 4.359 20 5 EIBDMO CC1(C)C[N@H+](Cc2ccc([N+](=O)[O-])cc2F)CC[C@@H]1C(F)(F)F ZINC000483426597 1040852462 /nfs/dbraw/zinc/85/24/62/1040852462.db2.gz FNKGQPAYYLTNCV-ZDUSSCGKSA-N 1 1 334.313 4.144 20 5 EIBDMO CC1(C)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)CC[C@@H]1C(F)(F)F ZINC000483426597 1040852470 /nfs/dbraw/zinc/85/24/70/1040852470.db2.gz FNKGQPAYYLTNCV-ZDUSSCGKSA-N 1 1 334.313 4.144 20 5 EIBDMO CC(C)c1ccc(CN[C@@H]2CC[N@@H+](CC3CCCC3)C2)cc1[N+](=O)[O-] ZINC000462748626 1040895921 /nfs/dbraw/zinc/89/59/21/1040895921.db2.gz DSTYMPLQZDGQBH-GOSISDBHSA-N 1 1 345.487 4.072 20 5 EIBDMO CC(C)c1ccc(C[NH2+][C@@H]2CCN(CC3CCCC3)C2)cc1[N+](=O)[O-] ZINC000462748626 1040895924 /nfs/dbraw/zinc/89/59/24/1040895924.db2.gz DSTYMPLQZDGQBH-GOSISDBHSA-N 1 1 345.487 4.072 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](C(F)(F)F)C(C)(C)C1 ZINC000484360372 1041217484 /nfs/dbraw/zinc/21/74/84/1041217484.db2.gz YSBFSKWJHVMJCC-AWEZNQCLSA-N 1 1 346.349 4.014 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C(F)(F)F)C(C)(C)C1 ZINC000484360372 1041217501 /nfs/dbraw/zinc/21/75/01/1041217501.db2.gz YSBFSKWJHVMJCC-AWEZNQCLSA-N 1 1 346.349 4.014 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccc(-c2ccco2)cc1F ZINC000515981263 1041310268 /nfs/dbraw/zinc/31/02/68/1041310268.db2.gz UMSQYSIZNLDBHP-UHFFFAOYSA-N 1 1 326.327 4.284 20 5 EIBDMO COc1ccccc1C[N@@H+](C)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000470171270 1041440727 /nfs/dbraw/zinc/44/07/27/1041440727.db2.gz HMRFZGSSMACSRZ-RVDMUPIBSA-N 1 1 326.396 4.139 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1cn[nH]c1 ZINC000540619841 1041569219 /nfs/dbraw/zinc/56/92/19/1041569219.db2.gz RMKAJDAYIKQMFN-SNVBAGLBSA-N 1 1 346.774 4.082 20 5 EIBDMO CCOC(C)(C)C[NH2+][C@H](c1ccc(CC)o1)c1ccc([N+](=O)[O-])cc1 ZINC000437101918 1041661110 /nfs/dbraw/zinc/66/11/10/1041661110.db2.gz VKHBISIBNTXBBU-SFHVURJKSA-N 1 1 346.427 4.244 20 5 EIBDMO CCC[C@H]([NH2+][C@@H](c1ccccc1F)[C@H](C)O)c1cccc([N+](=O)[O-])c1 ZINC000517035863 1041844435 /nfs/dbraw/zinc/84/44/35/1041844435.db2.gz RJYOVNOQTVDPRV-FASAQXTFSA-N 1 1 346.402 4.287 20 5 EIBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(Nc2ncc([N+](=O)[O-])s2)cc1 ZINC000443512440 1041872632 /nfs/dbraw/zinc/87/26/32/1041872632.db2.gz UFZQIDOABQBRQO-LBPRGKRZSA-N 1 1 332.429 4.169 20 5 EIBDMO COc1cccc(F)c1[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000122461977 1042073268 /nfs/dbraw/zinc/07/32/68/1042073268.db2.gz YNUWVSBQQPXAII-OLZOCXBDSA-N 1 1 332.375 4.463 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1cccs1)C[C@@H]1CCCO1 ZINC000541770705 1042108670 /nfs/dbraw/zinc/10/86/70/1042108670.db2.gz IPGVRSXIKIBNAT-KRWDZBQOSA-N 1 1 346.452 4.146 20 5 EIBDMO Cn1cc(C[N@H+]2CCCCC(C)(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000438351711 1042142104 /nfs/dbraw/zinc/14/21/04/1042142104.db2.gz HXFFGNLTPRIQNX-UHFFFAOYSA-N 1 1 342.443 4.007 20 5 EIBDMO CC[C@@]1(C)CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000464776955 1042158397 /nfs/dbraw/zinc/15/83/97/1042158397.db2.gz LMLPSCUXDOGOJG-IBGZPJMESA-N 1 1 343.427 4.304 20 5 EIBDMO CC(C)[C@@H](Cc1ccc(F)cc1)[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000464790968 1042169375 /nfs/dbraw/zinc/16/93/75/1042169375.db2.gz FKSKVMMXKWFXEU-MRXNPFEDSA-N 1 1 336.432 4.495 20 5 EIBDMO CC(C)(O)C[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542050484 1042257041 /nfs/dbraw/zinc/25/70/41/1042257041.db2.gz FMKDDRDPOFZNRR-UHFFFAOYSA-N 1 1 348.830 4.021 20 5 EIBDMO CC(C)(O)C[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542050484 1042257050 /nfs/dbraw/zinc/25/70/50/1042257050.db2.gz FMKDDRDPOFZNRR-UHFFFAOYSA-N 1 1 348.830 4.021 20 5 EIBDMO CC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@H](C)c1cccc(O)c1 ZINC000509554943 1042364492 /nfs/dbraw/zinc/36/44/92/1042364492.db2.gz HYRFGWYQTAKLEN-JOZWUWCOSA-N 1 1 326.396 4.397 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCc2ccccc2)Cc2cccnc2)cc1 ZINC000518440495 1042529589 /nfs/dbraw/zinc/52/95/89/1042529589.db2.gz WFVYTIRKXUGLHJ-UHFFFAOYSA-N 1 1 347.418 4.235 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@H](C)Cc1ccsc1 ZINC000426491894 1042762775 /nfs/dbraw/zinc/76/27/75/1042762775.db2.gz LEMNNSYGYCYCQJ-CYBMUJFWSA-N 1 1 334.441 4.118 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1ccc(O)cc1)CC1CC1 ZINC000519033119 1042796653 /nfs/dbraw/zinc/79/66/53/1042796653.db2.gz HGOQMKRQWPMTON-UHFFFAOYSA-N 1 1 326.396 4.021 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)cc1Cl ZINC000761506893 1042872186 /nfs/dbraw/zinc/87/21/86/1042872186.db2.gz OWAMJHFNOMCAJD-MRXNPFEDSA-N 1 1 332.787 4.291 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)cc1Cl ZINC000761506893 1042872190 /nfs/dbraw/zinc/87/21/90/1042872190.db2.gz OWAMJHFNOMCAJD-MRXNPFEDSA-N 1 1 332.787 4.291 20 5 EIBDMO CC(C)Oc1ccccc1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761524087 1042874684 /nfs/dbraw/zinc/87/46/84/1042874684.db2.gz UIBBMLBEPPEMTP-UHFFFAOYSA-N 1 1 334.803 4.325 20 5 EIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCS[C@@H]2CCCC[C@H]21 ZINC000493312627 1042895200 /nfs/dbraw/zinc/89/52/00/1042895200.db2.gz ZFMPWBRUOVMUPI-HUUCEWRRSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCS[C@@H]2CCCC[C@H]21 ZINC000493312627 1042895203 /nfs/dbraw/zinc/89/52/03/1042895203.db2.gz ZFMPWBRUOVMUPI-HUUCEWRRSA-N 1 1 326.849 4.108 20 5 EIBDMO Cc1cc(NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)ccc1[N+](=O)[O-] ZINC000493318129 1042895798 /nfs/dbraw/zinc/89/57/98/1042895798.db2.gz FTMKXXQIXWAAMD-HNNXBMFYSA-N 1 1 345.468 4.289 20 5 EIBDMO C[C@@H](Cc1ccc(O)cc1)[N@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493340343 1042899269 /nfs/dbraw/zinc/89/92/69/1042899269.db2.gz VUQWYQVNFDNVKA-LBPRGKRZSA-N 1 1 334.803 4.017 20 5 EIBDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493340343 1042899272 /nfs/dbraw/zinc/89/92/72/1042899272.db2.gz VUQWYQVNFDNVKA-LBPRGKRZSA-N 1 1 334.803 4.017 20 5 EIBDMO CCC(C)(C)[C@@H]1CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000441638262 1042947267 /nfs/dbraw/zinc/94/72/67/1042947267.db2.gz WVOKCJFVONCTSZ-HNNXBMFYSA-N 1 1 344.415 4.045 20 5 EIBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1cc2cccc(F)c2o1 ZINC000474004765 1042999567 /nfs/dbraw/zinc/99/95/67/1042999567.db2.gz AHPPGMZAKVOVQF-JTQLQIEISA-N 1 1 332.306 4.470 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H](c1ccccc1)C(C)C ZINC000303567919 1043073016 /nfs/dbraw/zinc/07/30/16/1043073016.db2.gz XZUHXPLSCHPVFG-IBGZPJMESA-N 1 1 328.412 4.433 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@]2(C1)CCc1ccccc1O2 ZINC000554947369 1043102066 /nfs/dbraw/zinc/10/20/66/1043102066.db2.gz ZENVQQQLCFXIIU-FOIQADDNSA-N 1 1 338.407 4.126 20 5 EIBDMO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000507861464 1043160118 /nfs/dbraw/zinc/16/01/18/1043160118.db2.gz QKWZFKXBIRMOGP-INIZCTEOSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000507861464 1043160129 /nfs/dbraw/zinc/16/01/29/1043160129.db2.gz QKWZFKXBIRMOGP-INIZCTEOSA-N 1 1 330.359 4.080 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1ccc(Br)o1 ZINC000030216630 1043184877 /nfs/dbraw/zinc/18/48/77/1043184877.db2.gz WAYJXBGEKYRSDB-JTQLQIEISA-N 1 1 339.189 4.143 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccc(Br)o1 ZINC000030216630 1043184889 /nfs/dbraw/zinc/18/48/89/1043184889.db2.gz WAYJXBGEKYRSDB-JTQLQIEISA-N 1 1 339.189 4.143 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1ccc(Br)o1 ZINC000030216627 1043185151 /nfs/dbraw/zinc/18/51/51/1043185151.db2.gz WAYJXBGEKYRSDB-SNVBAGLBSA-N 1 1 339.189 4.143 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccc(Br)o1 ZINC000030216627 1043185158 /nfs/dbraw/zinc/18/51/58/1043185158.db2.gz WAYJXBGEKYRSDB-SNVBAGLBSA-N 1 1 339.189 4.143 20 5 EIBDMO COCCCC[N@@H+](Cc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000065165542 1043279614 /nfs/dbraw/zinc/27/96/14/1043279614.db2.gz GKAICKNMAWJURZ-UHFFFAOYSA-N 1 1 328.412 4.024 20 5 EIBDMO CCC[N@@H+](C)C[C@H]1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000429199365 1043291497 /nfs/dbraw/zinc/29/14/97/1043291497.db2.gz BKPHWUDSWHSHEJ-LLVKDONJSA-N 1 1 346.258 4.070 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2cnc(-c3ccco3)s2)c1 ZINC000785484656 1043322176 /nfs/dbraw/zinc/32/21/76/1043322176.db2.gz JLRRMEOTTRQPKL-UHFFFAOYSA-N 1 1 349.799 4.255 20 5 EIBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)Nc2cccc(F)c2[N+](=O)[O-])cc1 ZINC000301757423 1043326808 /nfs/dbraw/zinc/32/68/08/1043326808.db2.gz YRCSLZGCYDOCOY-LBPRGKRZSA-N 1 1 340.358 4.401 20 5 EIBDMO COc1cc(C[N@@H+](C)C/C(C)=C\c2ccccc2)ccc1[N+](=O)[O-] ZINC000494232558 1043374182 /nfs/dbraw/zinc/37/41/82/1043374182.db2.gz BFWNFWDVADMZRA-PTNGSMBKSA-N 1 1 326.396 4.139 20 5 EIBDMO CC(C)[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCc1nccs1 ZINC000255597514 1043647773 /nfs/dbraw/zinc/64/77/73/1043647773.db2.gz RCAPVWLOZBMCHD-ALCCZGGFSA-N 1 1 331.441 4.018 20 5 EIBDMO COCC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@H](C)c1ccccc1 ZINC000521220912 1043656702 /nfs/dbraw/zinc/65/67/02/1043656702.db2.gz VKZAITMXFDDUOH-MRXNPFEDSA-N 1 1 328.412 4.113 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC(C)(C)C1 ZINC000543171532 1044036592 /nfs/dbraw/zinc/03/65/92/1044036592.db2.gz GDZMEDIFOZDTGL-ZDUSSCGKSA-N 1 1 329.400 4.118 20 5 EIBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000732989713 1044065039 /nfs/dbraw/zinc/06/50/39/1044065039.db2.gz UGKIOYROHDLOSJ-MRXNPFEDSA-N 1 1 348.349 4.089 20 5 EIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000732989713 1044065049 /nfs/dbraw/zinc/06/50/49/1044065049.db2.gz UGKIOYROHDLOSJ-MRXNPFEDSA-N 1 1 348.349 4.089 20 5 EIBDMO CCCO[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000116279347 1044156512 /nfs/dbraw/zinc/15/65/12/1044156512.db2.gz AAOVCSYJJVIHOO-HNNXBMFYSA-N 1 1 326.824 4.029 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@@H]4CCC[C@H]43)co2)cc1 ZINC000245918251 1044213043 /nfs/dbraw/zinc/21/30/43/1044213043.db2.gz SHHYSXSLWGOPJG-SUMWQHHRSA-N 1 1 327.384 4.014 20 5 EIBDMO CCC[C@H]1CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000466476681 1044582529 /nfs/dbraw/zinc/58/25/29/1044582529.db2.gz YNHWDHLFZMOBJO-HNNXBMFYSA-N 1 1 343.427 4.304 20 5 EIBDMO C[N@H+]1CCC[C@H](CNc2sccc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000301998242 1044663050 /nfs/dbraw/zinc/66/30/50/1044663050.db2.gz IFRBMDFWHJLNBH-BXUZGUMPSA-N 1 1 337.470 4.213 20 5 EIBDMO Cc1ccc2ccccc2c1C[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000543477831 1044687902 /nfs/dbraw/zinc/68/79/02/1044687902.db2.gz FLBNHIIQJNWQBI-UHFFFAOYSA-N 1 1 333.391 4.010 20 5 EIBDMO Cc1ccc2ccccc2c1C[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000543477831 1044687912 /nfs/dbraw/zinc/68/79/12/1044687912.db2.gz FLBNHIIQJNWQBI-UHFFFAOYSA-N 1 1 333.391 4.010 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)c1 ZINC000735491922 1044831968 /nfs/dbraw/zinc/83/19/68/1044831968.db2.gz PTZNBGLLLVQASJ-KRWDZBQOSA-N 1 1 332.787 4.291 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)c1 ZINC000735491922 1044831974 /nfs/dbraw/zinc/83/19/74/1044831974.db2.gz PTZNBGLLLVQASJ-KRWDZBQOSA-N 1 1 332.787 4.291 20 5 EIBDMO CSC[C@H]1CCC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000093760660 1044853008 /nfs/dbraw/zinc/85/30/08/1044853008.db2.gz YYIKGMYHZBSNRV-OAHLLOKOSA-N 1 1 349.481 4.046 20 5 EIBDMO C[C@]1([NH2+]Cc2c(F)cc([N+](=O)[O-])cc2F)CCCc2ccccc21 ZINC000508993985 1044886989 /nfs/dbraw/zinc/88/69/89/1044886989.db2.gz ZPZBIMSRPAPSBE-SFHVURJKSA-N 1 1 332.350 4.214 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCCC[C@@H]1c1ccncc1 ZINC000543626496 1044974184 /nfs/dbraw/zinc/97/41/84/1044974184.db2.gz CVCVLOAKSCUTIV-LJQANCHMSA-N 1 1 325.412 4.416 20 5 EIBDMO CCC[N@@H+](C)C[C@H]1CCN(c2c(Cl)cc([N+](=O)[O-])cc2Cl)C1 ZINC000302019462 1045153016 /nfs/dbraw/zinc/15/30/16/1045153016.db2.gz GZWDVAVRVRSXLQ-LLVKDONJSA-N 1 1 346.258 4.070 20 5 EIBDMO Cc1cccc(NC[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c1[N+](=O)[O-] ZINC000302490425 1045180789 /nfs/dbraw/zinc/18/07/89/1045180789.db2.gz JVOIPEWWYHTLLN-KSSFIOAISA-N 1 1 345.468 4.460 20 5 EIBDMO COCCN(C)CCC[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000915229038 1045200505 /nfs/dbraw/zinc/20/05/05/1045200505.db2.gz UFAHOESTWJBLRT-UHFFFAOYSA-N 1 1 336.479 4.051 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](C[C@@H]2CCOc3ccccc32)C2CC2)c1 ZINC000611254777 1045265936 /nfs/dbraw/zinc/26/59/36/1045265936.db2.gz UIMNRMUQQNXKOO-INIZCTEOSA-N 1 1 338.407 4.126 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2nccc3ccccc32)C2CC2)c1 ZINC000611254800 1045267255 /nfs/dbraw/zinc/26/72/55/1045267255.db2.gz OVXMFBQMQDHGNP-UHFFFAOYSA-N 1 1 333.391 4.308 20 5 EIBDMO CC(C)([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1cccc(Cl)c1 ZINC000611396576 1045301402 /nfs/dbraw/zinc/30/14/02/1045301402.db2.gz YKRRMFNLWWIQDM-UHFFFAOYSA-N 1 1 345.786 4.414 20 5 EIBDMO CC[C@@H]([NH2+]Cc1cccnc1OC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000324600268 1045805544 /nfs/dbraw/zinc/80/55/44/1045805544.db2.gz LOYBVKKFEUKKHS-QGZVFWFLSA-N 1 1 329.400 4.018 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCO[C@H](c3ccccc3)C2)ccc1Cl ZINC000768542236 1045817564 /nfs/dbraw/zinc/81/75/64/1045817564.db2.gz RMSPWTWBDASXNJ-SFHVURJKSA-N 1 1 346.814 4.212 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCO[C@H](c3ccccc3)C2)ccc1Cl ZINC000768542236 1045817567 /nfs/dbraw/zinc/81/75/67/1045817567.db2.gz RMSPWTWBDASXNJ-SFHVURJKSA-N 1 1 346.814 4.212 20 5 EIBDMO CC[N@@H+](Cc1cccc(F)c1)[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170352028 1046023137 /nfs/dbraw/zinc/02/31/37/1046023137.db2.gz JWBCAQFYKNNDEF-AWEZNQCLSA-N 1 1 346.402 4.196 20 5 EIBDMO Cc1ccc([C@@H](C)[N@H+](C)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c(C)c1 ZINC000792863296 1046078672 /nfs/dbraw/zinc/07/86/72/1046078672.db2.gz SYHYTKJDHFXJHV-CQSZACIVSA-N 1 1 343.383 4.313 20 5 EIBDMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c(C)c1 ZINC000792863296 1046078690 /nfs/dbraw/zinc/07/86/90/1046078690.db2.gz SYHYTKJDHFXJHV-CQSZACIVSA-N 1 1 343.383 4.313 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000792877372 1046089845 /nfs/dbraw/zinc/08/98/45/1046089845.db2.gz JVUGKIIOFFZRTP-KRWDZBQOSA-N 1 1 341.367 4.230 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000792877372 1046089856 /nfs/dbraw/zinc/08/98/56/1046089856.db2.gz JVUGKIIOFFZRTP-KRWDZBQOSA-N 1 1 341.367 4.230 20 5 EIBDMO COCc1cccc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC001170423499 1046115395 /nfs/dbraw/zinc/11/53/95/1046115395.db2.gz GXCZIBMAYKBLLK-IBGZPJMESA-N 1 1 340.423 4.121 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC(Cc3cccnc3)CC2)c1 ZINC000771462122 1046400746 /nfs/dbraw/zinc/40/07/46/1046400746.db2.gz UWDJOQYCLVBZBP-UHFFFAOYSA-N 1 1 345.830 4.098 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(Cc3cccnc3)CC2)ccc1Cl ZINC000771459168 1046402678 /nfs/dbraw/zinc/40/26/78/1046402678.db2.gz BWXFIOFQDHYFMH-UHFFFAOYSA-N 1 1 345.830 4.098 20 5 EIBDMO CC(C)c1ccc(C[N@@H+](C)[C@H](CCO)c2ccccc2)cc1[N+](=O)[O-] ZINC000536670696 1046650777 /nfs/dbraw/zinc/65/07/77/1046650777.db2.gz BAYPQVXZLVQKGR-LJQANCHMSA-N 1 1 342.439 4.274 20 5 EIBDMO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1)CCC2 ZINC000536697879 1046697973 /nfs/dbraw/zinc/69/79/73/1046697973.db2.gz HTZMMTGWHZFPBP-OAHLLOKOSA-N 1 1 345.468 4.432 20 5 EIBDMO Cc1c([C@H](C)[NH2+][C@H]2COc3ccc(Cl)cc32)cccc1[N+](=O)[O-] ZINC000536850454 1046822225 /nfs/dbraw/zinc/82/22/25/1046822225.db2.gz GZQCPYBPWHDACH-NHYWBVRUSA-N 1 1 332.787 4.341 20 5 EIBDMO CC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cc(Cl)ccc1OC ZINC000536875293 1046839528 /nfs/dbraw/zinc/83/95/28/1046839528.db2.gz GRCKBFAWXSWEEA-HNNXBMFYSA-N 1 1 334.803 4.498 20 5 EIBDMO CC[N@@H+](Cc1cccc(Cl)c1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000917462917 1046889044 /nfs/dbraw/zinc/88/90/44/1046889044.db2.gz PHISRHKHNUTAKA-UHFFFAOYSA-N 1 1 344.802 4.078 20 5 EIBDMO CC[N@H+](Cc1cccc(Cl)c1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000917462917 1046889056 /nfs/dbraw/zinc/88/90/56/1046889056.db2.gz PHISRHKHNUTAKA-UHFFFAOYSA-N 1 1 344.802 4.078 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[NH2+]C1(c2ccc(F)cc2F)CCCC1 ZINC000537129387 1046967497 /nfs/dbraw/zinc/96/74/97/1046967497.db2.gz SCLISBKMMSSVIA-UHFFFAOYSA-N 1 1 332.350 4.432 20 5 EIBDMO Cc1cccc(OCC[N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000788463025 1047192756 /nfs/dbraw/zinc/19/27/56/1047192756.db2.gz KELWLVXLSMGQCZ-UHFFFAOYSA-N 1 1 334.803 4.067 20 5 EIBDMO Cc1cccc(OCC[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000788463025 1047192747 /nfs/dbraw/zinc/19/27/47/1047192747.db2.gz KELWLVXLSMGQCZ-UHFFFAOYSA-N 1 1 334.803 4.067 20 5 EIBDMO CN(C)c1cccc([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)c1 ZINC000788479750 1047199369 /nfs/dbraw/zinc/19/93/69/1047199369.db2.gz AXPRSLOLBAPOMH-SFHVURJKSA-N 1 1 343.402 4.137 20 5 EIBDMO Cc1cccc(NC2CC[NH+](Cc3ccc([N+](=O)[O-])c(F)c3)CC2)c1 ZINC000788494463 1047201171 /nfs/dbraw/zinc/20/11/71/1047201171.db2.gz QMXBNORUDYXIJE-UHFFFAOYSA-N 1 1 343.402 4.119 20 5 EIBDMO CC(=O)Nc1cccc([C@H](C)[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000194767480 1047695121 /nfs/dbraw/zinc/69/51/21/1047695121.db2.gz XAKDVSXVGXOORV-NSHDSACASA-N 1 1 347.802 4.057 20 5 EIBDMO CC[N@@H+](Cc1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2)cc1)C(C)C ZINC000508785769 1047718642 /nfs/dbraw/zinc/71/86/42/1047718642.db2.gz SPPNGQRHPHYCHK-UHFFFAOYSA-N 1 1 341.411 4.077 20 5 EIBDMO COc1cccc(C2CC[NH+](Cc3csc([N+](=O)[O-])c3)CC2)c1 ZINC000194875518 1047811343 /nfs/dbraw/zinc/81/13/43/1047811343.db2.gz CDWXXRIDBNBQQN-UHFFFAOYSA-N 1 1 332.425 4.045 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cccnc3Cl)C2)cc1 ZINC000824820726 1047954816 /nfs/dbraw/zinc/95/48/16/1047954816.db2.gz LJHRFZVAMCRNFO-AWEZNQCLSA-N 1 1 331.803 4.023 20 5 EIBDMO Cc1c(C[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)cccc1[N+](=O)[O-] ZINC000556890697 1048131452 /nfs/dbraw/zinc/13/14/52/1048131452.db2.gz QJCMUKYEJPFVHX-KRWDZBQOSA-N 1 1 328.416 4.038 20 5 EIBDMO C[N@H+]1CCCC[C@@H]1CNC(=O)c1c2ccccc2cc2ccccc21 ZINC001134766329 1048243292 /nfs/dbraw/zinc/24/32/92/1048243292.db2.gz YTBJRTJUAJQGLT-GOSISDBHSA-N 1 1 332.447 4.207 20 5 EIBDMO C[C@@H]([NH2+][C@@H](C)c1nc2ccccc2s1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815580138 1048519947 /nfs/dbraw/zinc/51/99/47/1048519947.db2.gz CQMHXYITDHWJMP-MNOVXSKESA-N 1 1 342.424 4.199 20 5 EIBDMO CSCC[C@@H](C)[N@@H+](C)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809962454 1048570843 /nfs/dbraw/zinc/57/08/43/1048570843.db2.gz OIGQQJGVDPULJG-SECBINFHSA-N 1 1 337.272 4.475 20 5 EIBDMO C[C@@H](O)C[C@H]1CCCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809998360 1048599144 /nfs/dbraw/zinc/59/91/44/1048599144.db2.gz OXNGVRYKYYTNHW-ZWNOBZJWSA-N 1 1 347.242 4.027 20 5 EIBDMO C[C@@H](O)C[C@H]1CCCC[N@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809998360 1048599161 /nfs/dbraw/zinc/59/91/61/1048599161.db2.gz OXNGVRYKYYTNHW-ZWNOBZJWSA-N 1 1 347.242 4.027 20 5 EIBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(CNc2ncc([N+](=O)[O-])s2)cc1 ZINC000195508892 1048887020 /nfs/dbraw/zinc/88/70/20/1048887020.db2.gz BPUNYBILJHNYSM-CYBMUJFWSA-N 1 1 346.456 4.038 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[NH2+]C1(c2ccc(F)cc2)CCCC1 ZINC000609357665 1049033525 /nfs/dbraw/zinc/03/35/25/1049033525.db2.gz OEVIDVLKPZSOMT-UHFFFAOYSA-N 1 1 332.350 4.432 20 5 EIBDMO COCC[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000609705391 1049276018 /nfs/dbraw/zinc/27/60/18/1049276018.db2.gz YSPFJKADTYQKLC-AWEZNQCLSA-N 1 1 348.830 4.458 20 5 EIBDMO COCC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000609705391 1049276033 /nfs/dbraw/zinc/27/60/33/1049276033.db2.gz YSPFJKADTYQKLC-AWEZNQCLSA-N 1 1 348.830 4.458 20 5 EIBDMO Cc1cccc(OCC[N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000609704728 1049276796 /nfs/dbraw/zinc/27/67/96/1049276796.db2.gz BZGHJDSYALDFDG-UHFFFAOYSA-N 1 1 334.803 4.067 20 5 EIBDMO Cc1cccc(OCC[N@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000609704728 1049276809 /nfs/dbraw/zinc/27/68/09/1049276809.db2.gz BZGHJDSYALDFDG-UHFFFAOYSA-N 1 1 334.803 4.067 20 5 EIBDMO Cc1cc(NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)ccc1[N+](=O)[O-] ZINC000064550840 1049338492 /nfs/dbraw/zinc/33/84/92/1049338492.db2.gz FTMKXXQIXWAAMD-OAHLLOKOSA-N 1 1 345.468 4.289 20 5 EIBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCCCC[C@@H]2c2ccco2)cc1 ZINC000609916246 1049394372 /nfs/dbraw/zinc/39/43/72/1049394372.db2.gz PPVUCMMKYSRJKB-QGZVFWFLSA-N 1 1 330.384 4.184 20 5 EIBDMO CCCC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCC[C@@H](C)C1 ZINC001170683708 1049542929 /nfs/dbraw/zinc/54/29/29/1049542929.db2.gz SZZXNQUQSCGXAB-MNEFBYGVSA-N 1 1 334.460 4.309 20 5 EIBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812850820 1049611463 /nfs/dbraw/zinc/61/14/63/1049611463.db2.gz VTCZMWPHNPFREY-SCLBCKFNSA-N 1 1 348.830 4.192 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+]C1(c2cccc(F)c2)CC1 ZINC000179690739 1049720002 /nfs/dbraw/zinc/72/00/02/1049720002.db2.gz JEAQMOAVAIDNAT-UHFFFAOYSA-N 1 1 344.386 4.300 20 5 EIBDMO Cc1ccc([C@H](C)Nc2ccc([N+](=O)[O-])c3c2CC[N@H+](C)C3)c(C)c1 ZINC001170724865 1049870626 /nfs/dbraw/zinc/87/06/26/1049870626.db2.gz FHZXOOLSKBWFQT-HNNXBMFYSA-N 1 1 339.439 4.373 20 5 EIBDMO Cc1ccc([C@H](C)Nc2ccc([N+](=O)[O-])c3c2CC[N@@H+](C)C3)c(C)c1 ZINC001170724865 1049870627 /nfs/dbraw/zinc/87/06/27/1049870627.db2.gz FHZXOOLSKBWFQT-HNNXBMFYSA-N 1 1 339.439 4.373 20 5 EIBDMO CCN(CC)[C@@H](C[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C)CC(C)C ZINC001177209967 1050163225 /nfs/dbraw/zinc/16/32/25/1050163225.db2.gz URSCQRVGSAKCLN-QGZVFWFLSA-N 1 1 335.492 4.058 20 5 EIBDMO Cc1c(C[N@@H+]2CC=C(c3ccc(Cl)nc3)CC2)cccc1[N+](=O)[O-] ZINC000773658956 1050207379 /nfs/dbraw/zinc/20/73/79/1050207379.db2.gz SOOLTQBTDYVJGC-UHFFFAOYSA-N 1 1 343.814 4.241 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCC[C@@H]1c1ccncc1)CC2 ZINC001172915847 1050231965 /nfs/dbraw/zinc/23/19/65/1050231965.db2.gz PERJPAJYUCGKQJ-UYAOXDASSA-N 1 1 337.423 4.074 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCCC3(CC(F)C3)CC1)CC2 ZINC001172921338 1050234171 /nfs/dbraw/zinc/23/41/71/1050234171.db2.gz OWSHEAMFUBEBDY-FDYSRKEFSA-N 1 1 346.446 4.446 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+](Cc1ccco1)C1CC1)CC2 ZINC001172912489 1050246709 /nfs/dbraw/zinc/24/67/09/1050246709.db2.gz AHOHWOBHWFNHMO-INIZCTEOSA-N 1 1 326.396 4.100 20 5 EIBDMO CC1(C)CCC[N@@H+](CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001186267285 1050277190 /nfs/dbraw/zinc/27/71/90/1050277190.db2.gz OKMZWTBTDFIYPQ-UHFFFAOYSA-N 1 1 345.365 4.148 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2c3ccccc3oc2C1 ZINC001173232681 1050360028 /nfs/dbraw/zinc/36/00/28/1050360028.db2.gz SGDAMZYNZMKYGQ-CQSZACIVSA-N 1 1 336.391 4.330 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2c3ccccc3oc2C1 ZINC001173232681 1050360040 /nfs/dbraw/zinc/36/00/40/1050360040.db2.gz SGDAMZYNZMKYGQ-CQSZACIVSA-N 1 1 336.391 4.330 20 5 EIBDMO Cc1ccc([C@H]2CCC[N@@H+]2[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cn1 ZINC001173233703 1050362673 /nfs/dbraw/zinc/36/26/73/1050362673.db2.gz MFDZYYDBVZFRPO-HNAYVOBHSA-N 1 1 325.412 4.066 20 5 EIBDMO Cc1ccc([C@H]2CCC[N@@H+]2[C@H](C)Cc2ccc([N+](=O)[O-])cc2)cn1 ZINC001173233702 1050363197 /nfs/dbraw/zinc/36/31/97/1050363197.db2.gz MFDZYYDBVZFRPO-DNVCBOLYSA-N 1 1 325.412 4.066 20 5 EIBDMO Cc1ccccc1C[C@H](C)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000618551772 1050407993 /nfs/dbraw/zinc/40/79/93/1050407993.db2.gz ZWQOFKORSAHUEZ-AWEZNQCLSA-N 1 1 339.395 4.107 20 5 EIBDMO Cc1cccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cc3Cl)C2)c1 ZINC001187189744 1050498471 /nfs/dbraw/zinc/49/84/71/1050498471.db2.gz HHESHNAKOPMDFN-HNNXBMFYSA-N 1 1 345.830 4.243 20 5 EIBDMO C/C(=C\c1ccccc1)C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000775107760 1050504917 /nfs/dbraw/zinc/50/49/17/1050504917.db2.gz KRAHIWLWVWNNIY-GXDHUFHOSA-N 1 1 341.367 4.038 20 5 EIBDMO C/C(=C\c1ccccc1)C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000775107760 1050504930 /nfs/dbraw/zinc/50/49/30/1050504930.db2.gz KRAHIWLWVWNNIY-GXDHUFHOSA-N 1 1 341.367 4.038 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccc2cnccc2c1)C1CC1 ZINC000618808904 1050535756 /nfs/dbraw/zinc/53/57/56/1050535756.db2.gz JFZIDHDVXVFRBE-UHFFFAOYSA-N 1 1 333.391 4.308 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1CCc1ccccc1 ZINC001190392759 1051165612 /nfs/dbraw/zinc/16/56/12/1051165612.db2.gz SOSZUZWOUYHNSP-SFHVURJKSA-N 1 1 340.423 4.201 20 5 EIBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+](CC1CC1)C1CCC1 ZINC001181215131 1051189722 /nfs/dbraw/zinc/18/97/22/1051189722.db2.gz ZOJAPSSFCCFWOA-UHFFFAOYSA-N 1 1 328.334 4.378 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H](c2ccc(F)c(F)c2)C1 ZINC001174844850 1051208026 /nfs/dbraw/zinc/20/80/26/1051208026.db2.gz ICRJJDTYWAXIKH-AWEZNQCLSA-N 1 1 332.350 4.253 20 5 EIBDMO CC(C)C[N@@H+](CCc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC001190550859 1051214413 /nfs/dbraw/zinc/21/44/13/1051214413.db2.gz PQZWLOONYINXAH-UHFFFAOYSA-N 1 1 330.403 4.435 20 5 EIBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H](c3ccccc3)CC2)c1 ZINC001190781755 1051277898 /nfs/dbraw/zinc/27/78/98/1051277898.db2.gz XVYIXJYZNAFCDT-GOSISDBHSA-N 1 1 340.423 4.243 20 5 EIBDMO CCOc1c(Cl)cccc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC001181699072 1051293743 /nfs/dbraw/zinc/29/37/43/1051293743.db2.gz YMEYJZIJXFUTSZ-UHFFFAOYSA-N 1 1 348.830 4.321 20 5 EIBDMO C[C@H](c1cccnc1)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000183720075 1051320847 /nfs/dbraw/zinc/32/08/47/1051320847.db2.gz SBFQLVOKMCONPC-CQSZACIVSA-N 1 1 337.379 4.443 20 5 EIBDMO CC[C@@]1(C)CCC[N@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC001191215452 1051388634 /nfs/dbraw/zinc/38/86/34/1051388634.db2.gz UIYNDYJOOYCGJS-HNNXBMFYSA-N 1 1 341.249 4.369 20 5 EIBDMO CC[C@@]1(C)CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC001191215452 1051388644 /nfs/dbraw/zinc/38/86/44/1051388644.db2.gz UIYNDYJOOYCGJS-HNNXBMFYSA-N 1 1 341.249 4.369 20 5 EIBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CCC[C@H](C2CC2)C1 ZINC001182181854 1051413170 /nfs/dbraw/zinc/41/31/70/1051413170.db2.gz BFDWVKHJQKUNQS-LBPRGKRZSA-N 1 1 328.334 4.236 20 5 EIBDMO COc1ccc(C[N@H+]2CC[C@H](Cc3ccccc3)[C@@H]2C)cc1[N+](=O)[O-] ZINC001191475992 1051462197 /nfs/dbraw/zinc/46/21/97/1051462197.db2.gz QQDOYBCCPOXBEH-MAUKXSAKSA-N 1 1 340.423 4.057 20 5 EIBDMO CCC[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC001191985334 1051595422 /nfs/dbraw/zinc/59/54/22/1051595422.db2.gz AALDAGPFNSARPJ-LBPRGKRZSA-N 1 1 341.249 4.369 20 5 EIBDMO COc1ccc(C[N@H+]2CC=C(c3cccc(C)c3)CC2)cc1[N+](=O)[O-] ZINC001192557561 1051760104 /nfs/dbraw/zinc/76/01/04/1051760104.db2.gz UZBGZQRPINAWOU-UHFFFAOYSA-N 1 1 338.407 4.201 20 5 EIBDMO COc1ccc(C[N@@H+]2CC=C(c3cccc(C)c3)CC2)cc1[N+](=O)[O-] ZINC001192557561 1051760118 /nfs/dbraw/zinc/76/01/18/1051760118.db2.gz UZBGZQRPINAWOU-UHFFFAOYSA-N 1 1 338.407 4.201 20 5 EIBDMO CC[C@@H]([NH2+]Cc1nsc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC001192813910 1051814556 /nfs/dbraw/zinc/81/45/56/1051814556.db2.gz CWJFRWNJPQYJIN-OAHLLOKOSA-N 1 1 327.409 4.445 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@@H]2CCCC3(CCC3)O2)C2CC2)cc1 ZINC001192939420 1051841151 /nfs/dbraw/zinc/84/11/51/1051841151.db2.gz MWUUBGMKBWYAJP-SFHVURJKSA-N 1 1 330.428 4.051 20 5 EIBDMO CCOc1cccc(Cl)c1C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC001193743960 1051979681 /nfs/dbraw/zinc/97/96/81/1051979681.db2.gz XFESTZKXLVXKIH-UHFFFAOYSA-N 1 1 348.830 4.321 20 5 EIBDMO CCOc1cccc(Cl)c1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC001193743960 1051979686 /nfs/dbraw/zinc/97/96/86/1051979686.db2.gz XFESTZKXLVXKIH-UHFFFAOYSA-N 1 1 348.830 4.321 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCc2cc(F)cc(C)c2C1 ZINC001193773611 1051985315 /nfs/dbraw/zinc/98/53/15/1051985315.db2.gz TXLUJJINCBJBCR-AWEZNQCLSA-N 1 1 328.387 4.470 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCc2cc(F)cc(C)c2C1 ZINC001193773611 1051985324 /nfs/dbraw/zinc/98/53/24/1051985324.db2.gz TXLUJJINCBJBCR-AWEZNQCLSA-N 1 1 328.387 4.470 20 5 EIBDMO Cc1ccc([C@H]2C[C@H](C)[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)cc1 ZINC001193932530 1052023803 /nfs/dbraw/zinc/02/38/03/1052023803.db2.gz PSXUOMQHMSMSTI-YOEHRIQHSA-N 1 1 328.387 4.420 20 5 EIBDMO Cc1ccc([C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000774827199 1052163707 /nfs/dbraw/zinc/16/37/07/1052163707.db2.gz OYYWUEBVQWAZAU-QGZVFWFLSA-N 1 1 341.367 4.149 20 5 EIBDMO Cc1ccc([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000774827199 1052163713 /nfs/dbraw/zinc/16/37/13/1052163713.db2.gz OYYWUEBVQWAZAU-QGZVFWFLSA-N 1 1 341.367 4.149 20 5 EIBDMO CC[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])CC(C)(C)C ZINC001194626244 1052179631 /nfs/dbraw/zinc/17/96/31/1052179631.db2.gz PKKYLOBCCPUJQD-UHFFFAOYSA-N 1 1 329.238 4.225 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)c1 ZINC001185701501 1052284967 /nfs/dbraw/zinc/28/49/67/1052284967.db2.gz IVKJKPPYZDQINK-QGZVFWFLSA-N 1 1 345.487 4.384 20 5 EIBDMO CC(C)[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccc(F)cc1 ZINC000083132210 1052833710 /nfs/dbraw/zinc/83/37/10/1052833710.db2.gz JYZWSILGEUTKPD-GOSISDBHSA-N 1 1 343.358 4.362 20 5 EIBDMO CC(C)c1ccc(C[N@@H+](C)C[C@H](C)c2nccs2)cc1[N+](=O)[O-] ZINC000183255748 1052968081 /nfs/dbraw/zinc/96/80/81/1052968081.db2.gz VAJPCOOJGDZDMA-ZDUSSCGKSA-N 1 1 333.457 4.410 20 5 EIBDMO O=[N+]([O-])c1cccc2c1CCN(c1cc[nH+]c3cc(Cl)ccc31)C2 ZINC000864012001 1053135565 /nfs/dbraw/zinc/13/55/65/1053135565.db2.gz MEMQOEZAUXLSTL-UHFFFAOYSA-N 1 1 339.782 4.359 20 5 EIBDMO C[C@H](Cc1cccc(F)c1)[N@H+](C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC001195013824 1053210474 /nfs/dbraw/zinc/21/04/74/1053210474.db2.gz LYQAOAIIIORHQS-LLVKDONJSA-N 1 1 338.329 4.075 20 5 EIBDMO C[C@H](Cc1cccc(F)c1)[N@@H+](C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC001195013824 1053210502 /nfs/dbraw/zinc/21/05/02/1053210502.db2.gz LYQAOAIIIORHQS-LLVKDONJSA-N 1 1 338.329 4.075 20 5 EIBDMO CC[N@H+](CCOc1ccccc1C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC001195322891 1053358130 /nfs/dbraw/zinc/35/81/30/1053358130.db2.gz HIUXLWCAYSVYAX-UHFFFAOYSA-N 1 1 348.830 4.458 20 5 EIBDMO CC[N@@H+](CCOc1ccccc1C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC001195322891 1053358147 /nfs/dbraw/zinc/35/81/47/1053358147.db2.gz HIUXLWCAYSVYAX-UHFFFAOYSA-N 1 1 348.830 4.458 20 5 EIBDMO C[C@H]([NH2+]Cc1ccc(OC(F)F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000865418080 1053497101 /nfs/dbraw/zinc/49/71/01/1053497101.db2.gz HPGAQGLSULPOFO-JTQLQIEISA-N 1 1 340.301 4.186 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@H](c3ccccn3)C2)c1 ZINC000852086907 1053548419 /nfs/dbraw/zinc/54/84/19/1053548419.db2.gz CLFAGKSQZNHHEH-ZDUSSCGKSA-N 1 1 331.803 4.023 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@H](c3ccccn3)C2)c1 ZINC000852086907 1053548436 /nfs/dbraw/zinc/54/84/36/1053548436.db2.gz CLFAGKSQZNHHEH-ZDUSSCGKSA-N 1 1 331.803 4.023 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@@H](c3ccccn3)C2)c1 ZINC000852086906 1053549178 /nfs/dbraw/zinc/54/91/78/1053549178.db2.gz CLFAGKSQZNHHEH-CYBMUJFWSA-N 1 1 331.803 4.023 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@@H](c3ccccn3)C2)c1 ZINC000852086906 1053549189 /nfs/dbraw/zinc/54/91/89/1053549189.db2.gz CLFAGKSQZNHHEH-CYBMUJFWSA-N 1 1 331.803 4.023 20 5 EIBDMO CCC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCc2ccccc21 ZINC000776580322 1053563557 /nfs/dbraw/zinc/56/35/57/1053563557.db2.gz UFFHYEVLTUOMBX-WOJBJXKFSA-N 1 1 340.423 4.028 20 5 EIBDMO Cc1ccc(C)c([C@@H]2CCC[N@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000776585871 1053567187 /nfs/dbraw/zinc/56/71/87/1053567187.db2.gz BMMIOFRYYJYMTG-VQTJNVASSA-N 1 1 340.423 4.082 20 5 EIBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)C[C@H](C)C2CCCCC2)c1 ZINC001196820022 1053781085 /nfs/dbraw/zinc/78/10/85/1053781085.db2.gz XAKMWMNBTBOLCA-AWEZNQCLSA-N 1 1 348.443 4.030 20 5 EIBDMO C[C@H]([NH2+]Cc1ccc(OC(F)F)cc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872018400 1054332438 /nfs/dbraw/zinc/33/24/38/1054332438.db2.gz LMQILEALMXTSAA-JTQLQIEISA-N 1 1 340.301 4.186 20 5 EIBDMO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1F ZINC000872018903 1054333964 /nfs/dbraw/zinc/33/39/64/1054333964.db2.gz QWIMFSLVXDWLBA-MNOVXSKESA-N 1 1 336.338 4.293 20 5 EIBDMO CCc1noc(CC)c1C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872042594 1054356549 /nfs/dbraw/zinc/35/65/49/1054356549.db2.gz QFHZSBXZIMAEQH-NSHDSACASA-N 1 1 349.456 4.280 20 5 EIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@H](OC2CCC2)CC1 ZINC000872260388 1054427094 /nfs/dbraw/zinc/42/70/94/1054427094.db2.gz OZLMWEJKQVUONL-GINYUPMKSA-N 1 1 330.428 4.032 20 5 EIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@H](OC2CCC2)CC1 ZINC000872260389 1054427803 /nfs/dbraw/zinc/42/78/03/1054427803.db2.gz OZLMWEJKQVUONL-NCRRVARUSA-N 1 1 330.428 4.032 20 5 EIBDMO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1nc2c(s1)CCCC2 ZINC000173427207 1054938774 /nfs/dbraw/zinc/93/87/74/1054938774.db2.gz KMFLOEXCJHXUKM-NWDGAFQWSA-N 1 1 331.441 4.342 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCCCC[C@@H]2c2ccccc2)cc1 ZINC000776279767 1055153616 /nfs/dbraw/zinc/15/36/16/1055153616.db2.gz YUOPUQMZTAEIDG-WOJBJXKFSA-N 1 1 340.423 4.246 20 5 EIBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Nc1cccc(F)c1[N+](=O)[O-] ZINC000301588419 1055741388 /nfs/dbraw/zinc/74/13/88/1055741388.db2.gz PUUBGFJKUXNFAZ-YOEHRIQHSA-N 1 1 343.402 4.056 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCCc2cn(C(C)C)nc21 ZINC000765822230 1055751851 /nfs/dbraw/zinc/75/18/51/1055751851.db2.gz ZFKYTSGHINGXFR-KSSFIOAISA-N 1 1 342.443 4.409 20 5 EIBDMO Cc1c([C@H](C)[NH2+][C@@H]2c3ccc(F)cc3O[C@H]2C)cccc1[N+](=O)[O-] ZINC000554089418 1056008671 /nfs/dbraw/zinc/00/86/71/1056008671.db2.gz YDFRCRKJYRWANP-PZROIBLQSA-N 1 1 330.359 4.215 20 5 EIBDMO C[C@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000743855098 1059163504 /nfs/dbraw/zinc/16/35/04/1059163504.db2.gz YQJCMGJTJGRJFP-KPZWWZAWSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000743855098 1059163528 /nfs/dbraw/zinc/16/35/28/1059163528.db2.gz YQJCMGJTJGRJFP-KPZWWZAWSA-N 1 1 332.350 4.456 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]([C@H](C)c1ccccc1)C1CC1 ZINC000746115012 1060029308 /nfs/dbraw/zinc/02/93/08/1060029308.db2.gz FKYYXAOHBNVPSC-CQSZACIVSA-N 1 1 326.396 4.329 20 5 EIBDMO COc1cccc(C[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC(C)C)c1 ZINC000746154163 1060052371 /nfs/dbraw/zinc/05/23/71/1060052371.db2.gz MPFJEFSZXPISAS-UHFFFAOYSA-N 1 1 346.402 4.401 20 5 EIBDMO COc1ccccc1CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001168848372 1060481482 /nfs/dbraw/zinc/48/14/82/1060481482.db2.gz NGVNDLQKROERHS-UHFFFAOYSA-N 1 1 340.423 4.201 20 5 EIBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)C1 ZINC001169033197 1060591528 /nfs/dbraw/zinc/59/15/28/1060591528.db2.gz BIYHWJQPDBYGNP-BSIFCXSSSA-N 1 1 336.435 4.080 20 5 EIBDMO C[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1(C)C ZINC001169090595 1060645335 /nfs/dbraw/zinc/64/53/35/1060645335.db2.gz IPXPGFVTLIIFMS-NSHDSACASA-N 1 1 330.350 4.482 20 5 EIBDMO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2ccc([N+](=O)[O-])cc2OC)s1 ZINC000430216156 1019413583 /nfs/dbraw/zinc/41/35/83/1019413583.db2.gz DWBPSGBFMYWPMV-LBPRGKRZSA-N 1 1 349.456 4.124 20 5 EIBDMO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2OC)s1 ZINC000430216156 1019413605 /nfs/dbraw/zinc/41/36/05/1019413605.db2.gz DWBPSGBFMYWPMV-LBPRGKRZSA-N 1 1 349.456 4.124 20 5 EIBDMO CC[NH+](CC)C[C@@H](C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000609222363 1019883644 /nfs/dbraw/zinc/88/36/44/1019883644.db2.gz FRPBTBDLZFQNOI-CQSZACIVSA-N 1 1 347.484 4.143 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000609541480 1019965460 /nfs/dbraw/zinc/96/54/60/1019965460.db2.gz ROZAYOZJKCKYCO-CQSZACIVSA-N 1 1 346.814 4.246 20 5 EIBDMO CC(C)C[N@@H+](CCc1ccc(F)cc1)Cc1csc([N+](=O)[O-])c1 ZINC001167241318 1020653953 /nfs/dbraw/zinc/65/39/53/1020653953.db2.gz XNLDMLVQRFSTFG-UHFFFAOYSA-N 1 1 336.432 4.496 20 5 EIBDMO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000237949790 1020875241 /nfs/dbraw/zinc/87/52/41/1020875241.db2.gz OZBZUDYKQBDBNF-UXBLZVDNSA-N 1 1 335.363 4.053 20 5 EIBDMO Cc1cc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc(C)c1O ZINC000580127370 1021698110 /nfs/dbraw/zinc/69/81/10/1021698110.db2.gz JIJSKBXIFTXTQD-UHFFFAOYSA-N 1 1 326.396 4.082 20 5 EIBDMO Cc1cc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc(C)c1O ZINC000580127370 1021698122 /nfs/dbraw/zinc/69/81/22/1021698122.db2.gz JIJSKBXIFTXTQD-UHFFFAOYSA-N 1 1 326.396 4.082 20 5 EIBDMO C[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1nc2c(s1)CCC2 ZINC000414159188 1021991677 /nfs/dbraw/zinc/99/16/77/1021991677.db2.gz VSZGHLDTUUPSTO-NHYWBVRUSA-N 1 1 343.452 4.268 20 5 EIBDMO CCOc1cc(C[N@H+]2C[C@@H](c3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC001167396955 1022006354 /nfs/dbraw/zinc/00/63/54/1022006354.db2.gz DCHWSUDNONGHOC-QAPCUYQASA-N 1 1 340.423 4.372 20 5 EIBDMO CC(C)[C@H]1CCCC[N@H+]1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC001167405404 1022059094 /nfs/dbraw/zinc/05/90/94/1022059094.db2.gz DNDZQSRTUKLIQE-CQSZACIVSA-N 1 1 341.249 4.368 20 5 EIBDMO C[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000181579950 1022452473 /nfs/dbraw/zinc/45/24/73/1022452473.db2.gz YEBDTZDNYCJKDI-VIFPVBQESA-N 1 1 326.730 4.377 20 5 EIBDMO C[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC000180416664 1022649552 /nfs/dbraw/zinc/64/95/52/1022649552.db2.gz XRKAZONCMXBHKC-JTQLQIEISA-N 1 1 335.747 4.007 20 5 EIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc(C(F)(F)F)s1 ZINC000549411756 1022650726 /nfs/dbraw/zinc/65/07/26/1022650726.db2.gz TYJPFKYPACQZMH-UHFFFAOYSA-N 1 1 344.358 4.350 20 5 EIBDMO CCC(C)(C)[C@H]1CCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000156732420 1022739833 /nfs/dbraw/zinc/73/98/33/1022739833.db2.gz SJTCUGYFGLHQGI-OAHLLOKOSA-N 1 1 344.415 4.045 20 5 EIBDMO O=[N+]([O-])c1cc(F)ccc1C[NH+]1CCC(c2ccccc2F)CC1 ZINC001167443045 1022804129 /nfs/dbraw/zinc/80/41/29/1022804129.db2.gz LRNUVEBCHINVBF-UHFFFAOYSA-N 1 1 332.350 4.253 20 5 EIBDMO CCOC[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000126566483 1023368326 /nfs/dbraw/zinc/36/83/26/1023368326.db2.gz XOUAYJYQQSBTDS-OAHLLOKOSA-N 1 1 344.411 4.103 20 5 EIBDMO CC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1OC(F)F ZINC000101591771 1023759381 /nfs/dbraw/zinc/75/93/81/1023759381.db2.gz HLUWKJRUBRKEFO-CQSZACIVSA-N 1 1 336.338 4.437 20 5 EIBDMO Cc1c([C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cnn1C(C)(C)C ZINC000276581490 1023767244 /nfs/dbraw/zinc/76/72/44/1023767244.db2.gz VDMFOSMZBOLALY-OLZOCXBDSA-N 1 1 330.432 4.267 20 5 EIBDMO CC(C)[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1cccc(F)c1 ZINC000610581005 1024116066 /nfs/dbraw/zinc/11/60/66/1024116066.db2.gz WPYPOOZJOUEQLM-UHFFFAOYSA-N 1 1 343.358 4.286 20 5 EIBDMO CC(C)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1cccc(F)c1 ZINC000610581005 1024116083 /nfs/dbraw/zinc/11/60/83/1024116083.db2.gz WPYPOOZJOUEQLM-UHFFFAOYSA-N 1 1 343.358 4.286 20 5 EIBDMO Cc1c(C[N@H+]2CCC[C@@H]2CC(=O)c2cccs2)cccc1[N+](=O)[O-] ZINC000430995268 1024375590 /nfs/dbraw/zinc/37/55/90/1024375590.db2.gz CYICQFXLYRJHTD-OAHLLOKOSA-N 1 1 344.436 4.202 20 5 EIBDMO CC[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@H]1CCOC1 ZINC000611256750 1025344000 /nfs/dbraw/zinc/34/40/00/1025344000.db2.gz WHADQWQJTNNKIH-CQSZACIVSA-N 1 1 346.452 4.182 20 5 EIBDMO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC001167503942 1025456360 /nfs/dbraw/zinc/45/63/60/1025456360.db2.gz GKZWXHZCIQLKNX-XIKOKIGWSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC001167503942 1025456370 /nfs/dbraw/zinc/45/63/70/1025456370.db2.gz GKZWXHZCIQLKNX-XIKOKIGWSA-N 1 1 332.350 4.456 20 5 EIBDMO CCc1cnc(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)s1 ZINC000279044508 1026014662 /nfs/dbraw/zinc/01/46/62/1026014662.db2.gz JQNTYVMJXAQSAO-HNNXBMFYSA-N 1 1 331.441 4.126 20 5 EIBDMO CC1(C)C[C@@H]([NH2+]Cc2nc(C3CC3)cs2)c2cc([N+](=O)[O-])ccc21 ZINC000279064095 1026039901 /nfs/dbraw/zinc/03/99/01/1026039901.db2.gz LDQBQNSTAQWJIA-OAHLLOKOSA-N 1 1 343.452 4.441 20 5 EIBDMO COc1cc(C[N@@H+]2CCC[C@@H]2c2cccs2)c([N+](=O)[O-])cc1F ZINC000184225732 1026235067 /nfs/dbraw/zinc/23/50/67/1026235067.db2.gz TVQXFMNCXWNSRI-CYBMUJFWSA-N 1 1 336.388 4.141 20 5 EIBDMO COc1cc(C[N@H+]2CCC[C@@H]2c2cccs2)c([N+](=O)[O-])cc1F ZINC000184225732 1026235078 /nfs/dbraw/zinc/23/50/78/1026235078.db2.gz TVQXFMNCXWNSRI-CYBMUJFWSA-N 1 1 336.388 4.141 20 5 EIBDMO COc1cccc(F)c1[C@@H](C)[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000582191670 1026316346 /nfs/dbraw/zinc/31/63/46/1026316346.db2.gz GWKDEWAIJIQBED-ABAIWWIYSA-N 1 1 330.359 4.081 20 5 EIBDMO Cc1cc(Cl)cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000550200278 1026335462 /nfs/dbraw/zinc/33/54/62/1026335462.db2.gz ZUPOHGOICWXLHZ-UHFFFAOYSA-N 1 1 325.195 4.500 20 5 EIBDMO COc1c2ccccc2oc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000473796346 1026379442 /nfs/dbraw/zinc/37/94/42/1026379442.db2.gz NONUDYKBWZRGFA-GFCCVEGCSA-N 1 1 326.352 4.200 20 5 EIBDMO Cc1cc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c2ccccc2n1 ZINC000511105829 1026511300 /nfs/dbraw/zinc/51/13/00/1026511300.db2.gz KNDNWYTUJVMXAX-UHFFFAOYSA-N 1 1 335.407 4.126 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cccc(OC(F)F)c2)C2CC2)c1 ZINC000507175598 1026675687 /nfs/dbraw/zinc/67/56/87/1026675687.db2.gz WOLRFVWODCHZBC-UHFFFAOYSA-N 1 1 348.349 4.361 20 5 EIBDMO CCOc1cc(N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)ccc1[N+](=O)[O-] ZINC000302067148 1026676991 /nfs/dbraw/zinc/67/69/91/1026676991.db2.gz WODZTVBPCLTOBV-CABCVRRESA-N 1 1 347.459 4.058 20 5 EIBDMO COCc1ccccc1/C=C(/C)C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000507244797 1026719545 /nfs/dbraw/zinc/71/95/45/1026719545.db2.gz UFWVMPHPPDNXIF-VBKFSLOCSA-N 1 1 340.423 4.277 20 5 EIBDMO C[C@H]([NH2+]Cc1c(F)cccc1OC(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000267723997 1027320915 /nfs/dbraw/zinc/32/09/15/1027320915.db2.gz VFRVBHSWJBMUAK-JTQLQIEISA-N 1 1 340.301 4.186 20 5 EIBDMO CO[C@]1(C)CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000475561914 1027613110 /nfs/dbraw/zinc/61/31/10/1027613110.db2.gz RRIBOENSMQOQKL-LJQANCHMSA-N 1 1 344.411 4.246 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](CC(=O)OC(C)C)C1 ZINC000184486679 1027719945 /nfs/dbraw/zinc/71/99/45/1027719945.db2.gz YPECZGPFXWWMNA-HZPDHXFCSA-N 1 1 348.443 4.018 20 5 EIBDMO CCC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccc(F)cc1 ZINC000444627341 1027902177 /nfs/dbraw/zinc/90/21/77/1027902177.db2.gz XRDLXCINRKJPKU-UHFFFAOYSA-N 1 1 342.374 4.022 20 5 EIBDMO CCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccc(F)cc1 ZINC000444627341 1027902195 /nfs/dbraw/zinc/90/21/95/1027902195.db2.gz XRDLXCINRKJPKU-UHFFFAOYSA-N 1 1 342.374 4.022 20 5 EIBDMO CC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H]1CCCC[C@@H]1C ZINC000444674942 1027957363 /nfs/dbraw/zinc/95/73/63/1027957363.db2.gz KZNCXFNLAAKULX-BBRMVZONSA-N 1 1 344.415 4.045 20 5 EIBDMO CC(C)c1ccc(CN[C@H](CC[NH+](C)C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000522557806 1028004955 /nfs/dbraw/zinc/00/49/55/1028004955.db2.gz HSFGOAGVYYBIMQ-GOSISDBHSA-N 1 1 335.492 4.174 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)c1ccccc1SC ZINC000440643498 1028285559 /nfs/dbraw/zinc/28/55/59/1028285559.db2.gz JBRJHOJECWUOQP-LBPRGKRZSA-N 1 1 332.425 4.176 20 5 EIBDMO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1nccn1-c1ccccc1 ZINC000346948532 1028827080 /nfs/dbraw/zinc/82/70/80/1028827080.db2.gz QFZCHXSLWGBTML-LSDHHAIUSA-N 1 1 336.395 4.192 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@H](c2nccs2)C1 ZINC000245536684 1028871905 /nfs/dbraw/zinc/87/19/05/1028871905.db2.gz XRCMJIABLYPHHC-ZIAGYGMSSA-N 1 1 331.441 4.300 20 5 EIBDMO O=[N+]([O-])c1cccc(C[NH2+][C@@H]2COc3c2ccc(Cl)c3Cl)c1 ZINC000525182434 1029500883 /nfs/dbraw/zinc/50/08/83/1029500883.db2.gz XETDDPKWXXZWEV-CYBMUJFWSA-N 1 1 339.178 4.125 20 5 EIBDMO C[C@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)c1ccc([N+](=O)[O-])cc1 ZINC000451102453 1030248841 /nfs/dbraw/zinc/24/88/41/1030248841.db2.gz JMVXGSHZWLRYCI-ZDUSSCGKSA-N 1 1 329.400 4.018 20 5 EIBDMO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000026475227 1030310590 /nfs/dbraw/zinc/31/05/90/1030310590.db2.gz VKBCPEYSBFCXMJ-YWZLYKJASA-N 1 1 333.391 4.430 20 5 EIBDMO CC(C)c1noc([C@@H](C)[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451546440 1030561927 /nfs/dbraw/zinc/56/19/27/1030561927.db2.gz JHXMZEOAFRGECE-HIFRSBDPSA-N 1 1 344.415 4.042 20 5 EIBDMO CC(C)c1noc([C@@H](C)[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451546440 1030561949 /nfs/dbraw/zinc/56/19/49/1030561949.db2.gz JHXMZEOAFRGECE-HIFRSBDPSA-N 1 1 344.415 4.042 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@H]2CCC2CCCC2)cc1 ZINC001168175578 1030680692 /nfs/dbraw/zinc/68/06/92/1030680692.db2.gz OKNQIRVEPUWKCA-HKUYNNGSSA-N 1 1 332.444 4.063 20 5 EIBDMO Cc1c(C[N@H+](Cc2cccs2)C[C@@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000051429683 1030856169 /nfs/dbraw/zinc/85/61/69/1030856169.db2.gz ZYWIHQMIUGQRNK-INIZCTEOSA-N 1 1 346.452 4.146 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2ccco2)C2CCCC2)cc1[N+](=O)[O-] ZINC000052077267 1030965047 /nfs/dbraw/zinc/96/50/47/1030965047.db2.gz IFLSSXQVINFCCP-UHFFFAOYSA-N 1 1 330.384 4.141 20 5 EIBDMO Cc1ncc(C[N@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)s1 ZINC000179382196 1031039620 /nfs/dbraw/zinc/03/96/20/1031039620.db2.gz BTKUCGQBULRUDY-UHFFFAOYSA-N 1 1 343.408 4.252 20 5 EIBDMO Cc1ncc(C[N@@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)s1 ZINC000179382196 1031039637 /nfs/dbraw/zinc/03/96/37/1031039637.db2.gz BTKUCGQBULRUDY-UHFFFAOYSA-N 1 1 343.408 4.252 20 5 EIBDMO CC(C)[N@H+](Cc1ccnn1C1CCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000449012779 1031344231 /nfs/dbraw/zinc/34/42/31/1031344231.db2.gz GXRDRHGJIXWHCH-UHFFFAOYSA-N 1 1 342.443 4.317 20 5 EIBDMO CC(C)[N@@H+](Cc1ccnn1C1CCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000449012779 1031344248 /nfs/dbraw/zinc/34/42/48/1031344248.db2.gz GXRDRHGJIXWHCH-UHFFFAOYSA-N 1 1 342.443 4.317 20 5 EIBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@H](C)Cc1ccc(OC)cc1 ZINC000520194989 1031400555 /nfs/dbraw/zinc/40/05/55/1031400555.db2.gz OMZVMQJFSJJTSO-OAHLLOKOSA-N 1 1 342.439 4.365 20 5 EIBDMO C[C@H](N[C@H]1CC[N@H+](C)[C@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000453222235 1031740262 /nfs/dbraw/zinc/74/02/62/1031740262.db2.gz KZGMSUQFIUJAQE-QSFXBCCZSA-N 1 1 339.439 4.081 20 5 EIBDMO C[C@H](N[C@H]1CC[N@@H+](C)[C@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000453222235 1031740282 /nfs/dbraw/zinc/74/02/82/1031740282.db2.gz KZGMSUQFIUJAQE-QSFXBCCZSA-N 1 1 339.439 4.081 20 5 EIBDMO Cc1nc(C)c(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000449494316 1031804238 /nfs/dbraw/zinc/80/42/38/1031804238.db2.gz ABZONKVMFVGYAP-HNNXBMFYSA-N 1 1 331.441 4.048 20 5 EIBDMO Cc1ccc(C[NH2+][C@@H]2CCc3cc(F)c(F)c(F)c32)cc1[N+](=O)[O-] ZINC000449587289 1031864858 /nfs/dbraw/zinc/86/48/58/1031864858.db2.gz OHHZOVGOTAEYPX-CYBMUJFWSA-N 1 1 336.313 4.098 20 5 EIBDMO C[C@@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC(C)(C)C1 ZINC000542251769 1033799277 /nfs/dbraw/zinc/79/92/77/1033799277.db2.gz AXMXONBWQVFMSG-AWEZNQCLSA-N 1 1 343.427 4.160 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@H](c4ccccc4)C3)nc2c1 ZINC000433083671 1033816149 /nfs/dbraw/zinc/81/61/49/1033816149.db2.gz QGRMCBMPLSQCTJ-OAHLLOKOSA-N 1 1 337.379 4.116 20 5 EIBDMO Cn1c[nH+]c2cc(N[C@H]3CC(C)(C)c4ccc([N+](=O)[O-])cc43)ccc21 ZINC000433226709 1034062064 /nfs/dbraw/zinc/06/20/64/1034062064.db2.gz OECVPJMEENBNBF-KRWDZBQOSA-N 1 1 336.395 4.316 20 5 EIBDMO Cc1ccc(C[NH2+]Cc2csc([N+](=O)[O-])c2)c(OC(C)(C)C)c1 ZINC000150972042 1034063594 /nfs/dbraw/zinc/06/35/94/1034063594.db2.gz RIYKISOPKGWLJL-UHFFFAOYSA-N 1 1 334.441 4.432 20 5 EIBDMO C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccc(C2CC2)cc1 ZINC000419361795 1034477045 /nfs/dbraw/zinc/47/70/45/1034477045.db2.gz UKQGIPRZAJBWJE-GFCCVEGCSA-N 1 1 337.379 4.464 20 5 EIBDMO Cc1ccc(C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(F)F)s1 ZINC000513402446 1034917635 /nfs/dbraw/zinc/91/76/35/1034917635.db2.gz XADRATLWBJYREJ-UHFFFAOYSA-N 1 1 342.367 4.198 20 5 EIBDMO Cc1ccc(C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(F)F)s1 ZINC000513402446 1034917639 /nfs/dbraw/zinc/91/76/39/1034917639.db2.gz XADRATLWBJYREJ-UHFFFAOYSA-N 1 1 342.367 4.198 20 5 EIBDMO CCC[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC)c1ccccn1 ZINC000595015048 1035507648 /nfs/dbraw/zinc/50/76/48/1035507648.db2.gz XQRVCWOUQWZBNO-CXAGYDPISA-N 1 1 329.400 4.190 20 5 EIBDMO COc1cccc(C2([NH2+]Cc3ccc([N+](=O)[O-])cc3Cl)CCC2)c1 ZINC000594997262 1035522501 /nfs/dbraw/zinc/52/25/01/1035522501.db2.gz JXNZXHJMIYQOBZ-UHFFFAOYSA-N 1 1 346.814 4.426 20 5 EIBDMO C[C@H]([NH2+]Cc1cc(F)ccc1OC(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000595094295 1035602981 /nfs/dbraw/zinc/60/29/81/1035602981.db2.gz VMBZNBWXXSICHF-JTQLQIEISA-N 1 1 340.301 4.186 20 5 EIBDMO CC[N@@H+](Cc1ccc(OC)c(OC)c1)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000485070512 1035658387 /nfs/dbraw/zinc/65/83/87/1035658387.db2.gz CYACQEPXTWQXQK-AWEZNQCLSA-N 1 1 344.411 4.195 20 5 EIBDMO Cc1noc(C[NH2+]C2(c3cccc(Cl)c3)CCCC2)c1[N+](=O)[O-] ZINC000595418118 1035675502 /nfs/dbraw/zinc/67/55/02/1035675502.db2.gz CGBNBJWXVBNYDL-UHFFFAOYSA-N 1 1 335.791 4.104 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H]([C@@H]2CCCCO2)C1 ZINC000595789234 1035794722 /nfs/dbraw/zinc/79/47/22/1035794722.db2.gz PVRVJJQIOOMAKW-FCEWJHQRSA-N 1 1 332.444 4.245 20 5 EIBDMO COc1cc(C[N@H+]2CCC[C@@H]2c2ccc(C)s2)ccc1[N+](=O)[O-] ZINC000485459155 1035892523 /nfs/dbraw/zinc/89/25/23/1035892523.db2.gz WMIZBNMHBJMRGL-OAHLLOKOSA-N 1 1 332.425 4.310 20 5 EIBDMO O=[N+]([O-])c1cc(C(F)F)ccc1NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596571583 1035898116 /nfs/dbraw/zinc/89/81/16/1035898116.db2.gz WUQJPVDSGWHKLW-ZDUSSCGKSA-N 1 1 339.386 4.066 20 5 EIBDMO C[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])s2)[C@@H]1c1cccs1 ZINC000078338324 1036067537 /nfs/dbraw/zinc/06/75/37/1036067537.db2.gz QJBGYZQFGUKPKZ-XHDPSFHLSA-N 1 1 337.470 4.213 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@H](C)c1cccc(OC)c1 ZINC000485801836 1036283862 /nfs/dbraw/zinc/28/38/62/1036283862.db2.gz QVEQJJFLQQBWET-CQSZACIVSA-N 1 1 344.411 4.195 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1Br ZINC000034996169 1036503890 /nfs/dbraw/zinc/50/38/90/1036503890.db2.gz QHKKPBHEBYEQOC-LLVKDONJSA-N 1 1 335.201 4.208 20 5 EIBDMO CC1(C)C[C@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)c2ccccc21 ZINC000602576440 1036506037 /nfs/dbraw/zinc/50/60/37/1036506037.db2.gz NTPVLDXHUWMZBF-INIZCTEOSA-N 1 1 337.379 4.248 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[NH2+][C@@H]3CCCc4ccc(F)cc43)nc2c1 ZINC000602637523 1036548242 /nfs/dbraw/zinc/54/82/42/1036548242.db2.gz DIKAODWWYZYSGK-OAHLLOKOSA-N 1 1 341.342 4.042 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[NH2+][C@H]3CCCc4c(F)cccc43)nc2c1 ZINC000602671019 1036549925 /nfs/dbraw/zinc/54/99/25/1036549925.db2.gz HDDXIVXIEAEHDF-HNNXBMFYSA-N 1 1 341.342 4.042 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[NH2+]C3(c4cccc(F)c4)CCC3)nc2c1 ZINC000602701390 1036576637 /nfs/dbraw/zinc/57/66/37/1036576637.db2.gz QQAOQAXZDMRCPD-UHFFFAOYSA-N 1 1 341.342 4.044 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](c2ccc3cccnc3n2)C1 ZINC000602886123 1036659890 /nfs/dbraw/zinc/65/98/90/1036659890.db2.gz HBOVWDSAJKYDTE-ZBFHGGJFSA-N 1 1 348.406 4.089 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000589200206 1036706578 /nfs/dbraw/zinc/70/65/78/1036706578.db2.gz WJKXSVIJKNQLJS-QMBNUAFSSA-N 1 1 344.455 4.137 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@H](C4CC4)C3)cs2)c1 ZINC000589209291 1036710684 /nfs/dbraw/zinc/71/06/84/1036710684.db2.gz BYKIDDMQEHNUEH-HNNXBMFYSA-N 1 1 343.452 4.340 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC34CCCC4)cs2)c1 ZINC000593644702 1036819198 /nfs/dbraw/zinc/81/91/98/1036819198.db2.gz DYYODMARSCYUIQ-UHFFFAOYSA-N 1 1 329.425 4.237 20 5 EIBDMO COc1cc(C[N@@H+](C)[C@@H](C)C(C)(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000603553586 1036882833 /nfs/dbraw/zinc/88/28/33/1036882833.db2.gz DNSALSMXEBDDHB-JTQLQIEISA-N 1 1 346.374 4.071 20 5 EIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000603840449 1037057091 /nfs/dbraw/zinc/05/70/91/1037057091.db2.gz DZKIBMJDEIMIBA-INIZCTEOSA-N 1 1 346.814 4.464 20 5 EIBDMO C[N@@H+](CCCOc1ccc(Cl)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000603867236 1037064037 /nfs/dbraw/zinc/06/40/37/1037064037.db2.gz GGDSYUHLEJKHSJ-UHFFFAOYSA-N 1 1 334.803 4.149 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(Cc3cccc(F)c3)CC2)cs1 ZINC000603934203 1037111951 /nfs/dbraw/zinc/11/19/51/1037111951.db2.gz PPVVYZDREAWXAL-UHFFFAOYSA-N 1 1 334.416 4.250 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](c2ccccn2)C1 ZINC000590599987 1037114522 /nfs/dbraw/zinc/11/45/22/1037114522.db2.gz INPBYQXFNFVGBK-JKSUJKDBSA-N 1 1 325.412 4.239 20 5 EIBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@H]2c2cccc(F)c2)cc1 ZINC000604013533 1037147338 /nfs/dbraw/zinc/14/73/38/1037147338.db2.gz OCMWYXLKIZUHRT-IBGZPJMESA-N 1 1 344.386 4.340 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1c1cccc(C)c1 ZINC000604013358 1037150408 /nfs/dbraw/zinc/15/04/08/1037150408.db2.gz CIGXHSLOVGDNJV-SFHVURJKSA-N 1 1 326.396 4.249 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000604435662 1037391725 /nfs/dbraw/zinc/39/17/25/1037391725.db2.gz OGCNQGQXRWFBOU-CLCXKQKWSA-N 1 1 326.396 4.118 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000604435662 1037391733 /nfs/dbraw/zinc/39/17/33/1037391733.db2.gz OGCNQGQXRWFBOU-CLCXKQKWSA-N 1 1 326.396 4.118 20 5 EIBDMO C[C@H]1CSCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000488397695 1037566442 /nfs/dbraw/zinc/56/64/42/1037566442.db2.gz NXYWIGDRBSAZLF-CYBMUJFWSA-N 1 1 332.425 4.040 20 5 EIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)CCC(C)(C)C ZINC000592145604 1037748348 /nfs/dbraw/zinc/74/83/48/1037748348.db2.gz ZKXWNMDCSXEWNB-GFCCVEGCSA-N 1 1 332.404 4.074 20 5 EIBDMO COCC[C@@H]([NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)c1ccco1 ZINC000503932493 1038019193 /nfs/dbraw/zinc/01/91/93/1038019193.db2.gz URPYJVCCBYLLLT-MRXNPFEDSA-N 1 1 332.400 4.179 20 5 EIBDMO Cc1[nH+]ccn1-c1ccc(CNc2ccc([N+](=O)[O-])c(C)c2)cc1F ZINC000063254806 1038137476 /nfs/dbraw/zinc/13/74/76/1038137476.db2.gz BEAGPEBXKGCWAU-UHFFFAOYSA-N 1 1 340.358 4.149 20 5 EIBDMO COc1cc(C[N@@H+](C2CC2)[C@@H]2CCc3ccccc32)ccc1[N+](=O)[O-] ZINC000490015849 1038316433 /nfs/dbraw/zinc/31/64/33/1038316433.db2.gz WOTKDWNQXYOJMW-GOSISDBHSA-N 1 1 338.407 4.255 20 5 EIBDMO COc1ccc(CCC[N@@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000490312297 1038494132 /nfs/dbraw/zinc/49/41/32/1038494132.db2.gz BDXQQCLWUMRHEL-HNNXBMFYSA-N 1 1 328.412 4.229 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+]Cc2cccc(OC(C)(C)C)n2)cc1[N+](=O)[O-] ZINC000539061913 1038806780 /nfs/dbraw/zinc/80/67/80/1038806780.db2.gz QIFGWRCYRBIWRC-AWEZNQCLSA-N 1 1 343.427 4.326 20 5 EIBDMO Cc1ccc(C(=O)CC[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000480895388 1038865620 /nfs/dbraw/zinc/86/56/20/1038865620.db2.gz HXHHEKBCDWESJR-UHFFFAOYSA-N 1 1 338.407 4.141 20 5 EIBDMO Cc1ccc(C(=O)CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000480895388 1038865623 /nfs/dbraw/zinc/86/56/23/1038865623.db2.gz HXHHEKBCDWESJR-UHFFFAOYSA-N 1 1 338.407 4.141 20 5 EIBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@@H]1CCCOC1 ZINC000119753979 1038999250 /nfs/dbraw/zinc/99/92/50/1038999250.db2.gz XINBKQBFZWPFAA-AWEZNQCLSA-N 1 1 346.452 4.182 20 5 EIBDMO C[C@@H]1C[C@@H]1[C@@H](NCc1cc([O-])ccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000555422310 1039177065 /nfs/dbraw/zinc/17/70/65/1039177065.db2.gz UARWOQLKZFFFJV-VOZBZGINSA-N 1 1 346.814 4.441 20 5 EIBDMO Cc1ccc(C[N@H+]2CCCCC[C@@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000505282599 1039188953 /nfs/dbraw/zinc/18/89/53/1039188953.db2.gz BQDOWFOFVPHSRU-GOSISDBHSA-N 1 1 325.412 4.416 20 5 EIBDMO CC(C)[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1cccc(F)c1 ZINC000514086722 1039585004 /nfs/dbraw/zinc/58/50/04/1039585004.db2.gz CLLCHXSRDCHREY-UHFFFAOYSA-N 1 1 332.375 4.023 20 5 EIBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000434986536 1039983936 /nfs/dbraw/zinc/98/39/36/1039983936.db2.gz OYWYOUFSBONCED-SFHVURJKSA-N 1 1 326.396 4.249 20 5 EIBDMO C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000482314542 1040168440 /nfs/dbraw/zinc/16/84/40/1040168440.db2.gz KAZUFHRIVPBCSY-FRQCXROJSA-N 1 1 339.439 4.081 20 5 EIBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000482314542 1040168470 /nfs/dbraw/zinc/16/84/70/1040168470.db2.gz KAZUFHRIVPBCSY-FRQCXROJSA-N 1 1 339.439 4.081 20 5 EIBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1cccc2ccccc21 ZINC000482690641 1040430517 /nfs/dbraw/zinc/43/05/17/1040430517.db2.gz HUUJOJRZOIWLKW-UHFFFAOYSA-N 1 1 346.390 4.256 20 5 EIBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1cccc2ccccc21 ZINC000482690641 1040430526 /nfs/dbraw/zinc/43/05/26/1040430526.db2.gz HUUJOJRZOIWLKW-UHFFFAOYSA-N 1 1 346.390 4.256 20 5 EIBDMO C[C@@H](c1cccc(Cl)c1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482704536 1040439468 /nfs/dbraw/zinc/43/94/68/1040439468.db2.gz KTESTNHEAVBFOS-NSHDSACASA-N 1 1 344.802 4.318 20 5 EIBDMO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482704536 1040439475 /nfs/dbraw/zinc/43/94/75/1040439475.db2.gz KTESTNHEAVBFOS-NSHDSACASA-N 1 1 344.802 4.318 20 5 EIBDMO C[C@H](c1ccccc1)[N@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089883091 1040493665 /nfs/dbraw/zinc/49/36/65/1040493665.db2.gz VUQWQKIEFFBDKX-CQSZACIVSA-N 1 1 337.379 4.443 20 5 EIBDMO C[C@H](c1ccccc1)[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089883091 1040493678 /nfs/dbraw/zinc/49/36/78/1040493678.db2.gz VUQWQKIEFFBDKX-CQSZACIVSA-N 1 1 337.379 4.443 20 5 EIBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[C@H](C)C1 ZINC000443063646 1040508343 /nfs/dbraw/zinc/50/83/43/1040508343.db2.gz DLCYPOCNFNAOAV-CZUORRHYSA-N 1 1 346.452 4.323 20 5 EIBDMO C[C@@H](c1ccsc1)[NH+]1CCN([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000462454437 1040619744 /nfs/dbraw/zinc/61/97/44/1040619744.db2.gz HALGVZJFZXRPNR-GJZGRUSLSA-N 1 1 345.468 4.096 20 5 EIBDMO Cc1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)cc1[N+](=O)[O-] ZINC000483434569 1040858594 /nfs/dbraw/zinc/85/85/94/1040858594.db2.gz DRSGAPUCVSIPGH-CQSZACIVSA-N 1 1 330.350 4.314 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000192932871 1040921561 /nfs/dbraw/zinc/92/15/61/1040921561.db2.gz YWJGZFRFPDHPIB-GFCCVEGCSA-N 1 1 327.409 4.364 20 5 EIBDMO CC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H](C)c1ccc(F)cc1 ZINC000516198726 1041450959 /nfs/dbraw/zinc/45/09/59/1041450959.db2.gz ZUVLXDDIAVGXHD-ZDUSSCGKSA-N 1 1 332.375 4.326 20 5 EIBDMO CC[C@@H](c1ccccc1)[C@@H]1CCC[N@H+]1Cc1onc(C)c1[N+](=O)[O-] ZINC000595297326 1041459361 /nfs/dbraw/zinc/45/93/61/1041459361.db2.gz RHWFDLMKOCGLGP-HOTGVXAUSA-N 1 1 329.400 4.049 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCO[C@](C)(c2ccccc2)C1 ZINC000538709454 1041482681 /nfs/dbraw/zinc/48/26/81/1041482681.db2.gz PVYOBXFOVRRDSJ-JXFKEZNVSA-N 1 1 340.423 4.212 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCO[C@](C)(c2ccccc2)C1 ZINC000538709454 1041482684 /nfs/dbraw/zinc/48/26/84/1041482684.db2.gz PVYOBXFOVRRDSJ-JXFKEZNVSA-N 1 1 340.423 4.212 20 5 EIBDMO CCCO[C@H]1CCC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000470176546 1041547117 /nfs/dbraw/zinc/54/71/17/1041547117.db2.gz XIYHTRCSIJPBNL-AGWAZZAUSA-N 1 1 332.444 4.279 20 5 EIBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@H](C)c1cccc(OC)c1 ZINC000516616629 1041675860 /nfs/dbraw/zinc/67/58/60/1041675860.db2.gz VNOLRRKQKYJVAW-OAHLLOKOSA-N 1 1 328.412 4.495 20 5 EIBDMO CC[C@H](C)[C@H](C)[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC1 ZINC000517134406 1041879388 /nfs/dbraw/zinc/87/93/88/1041879388.db2.gz AFOSLQCBALXFQG-STQMWFEESA-N 1 1 344.415 4.044 20 5 EIBDMO CC[C@H](C)[C@@H](C)[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC1 ZINC000517134405 1041879632 /nfs/dbraw/zinc/87/96/32/1041879632.db2.gz AFOSLQCBALXFQG-QWHCGFSZSA-N 1 1 344.415 4.044 20 5 EIBDMO C[C@@H](CN[C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)C[NH+](C)C ZINC000425944921 1042032979 /nfs/dbraw/zinc/03/29/79/1042032979.db2.gz ZEYJNUSTYKLPDO-KBPBESRZSA-N 1 1 347.484 4.172 20 5 EIBDMO C[C@@H](C[NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)CN(C)C ZINC000425944921 1042032986 /nfs/dbraw/zinc/03/29/86/1042032986.db2.gz ZEYJNUSTYKLPDO-KBPBESRZSA-N 1 1 347.484 4.172 20 5 EIBDMO COc1ccc2c(c1)CCC[N@@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000609133849 1042058203 /nfs/dbraw/zinc/05/82/03/1042058203.db2.gz BWQJQFZYNQJRFU-AWEZNQCLSA-N 1 1 326.396 4.113 20 5 EIBDMO C[C@@H]1C[C@H](c2ccccc2F)[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000464729075 1042142477 /nfs/dbraw/zinc/14/24/77/1042142477.db2.gz ZGUSGFVDSNJEPY-AUUYWEPGSA-N 1 1 328.387 4.360 20 5 EIBDMO C[C@@H]1C[C@@H](c2ccccc2F)[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000464729243 1042143851 /nfs/dbraw/zinc/14/38/51/1042143851.db2.gz DDMQSTAPTZYJBE-KDOFPFPSSA-N 1 1 344.386 4.196 20 5 EIBDMO CSC[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000549718060 1042244171 /nfs/dbraw/zinc/24/41/71/1042244171.db2.gz SZIHPTKQAXDMHT-LLVKDONJSA-N 1 1 348.390 4.189 20 5 EIBDMO CC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@@H](C)c1cccc(O)c1 ZINC000509554944 1042364635 /nfs/dbraw/zinc/36/46/35/1042364635.db2.gz HYRFGWYQTAKLEN-VSGCLNPGSA-N 1 1 326.396 4.397 20 5 EIBDMO CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccc(F)cc1 ZINC000518472987 1042538996 /nfs/dbraw/zinc/53/89/96/1042538996.db2.gz DNPUMXFNTZBCOY-AWEZNQCLSA-N 1 1 332.375 4.196 20 5 EIBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@@H](C)c1cccc(OC)c1 ZINC000518472767 1042539354 /nfs/dbraw/zinc/53/93/54/1042539354.db2.gz NNRLZZOLCGZNQM-AWEZNQCLSA-N 1 1 344.411 4.195 20 5 EIBDMO CC(C)([NH2+]Cc1cnc(-c2ccco2)s1)c1ccccc1[N+](=O)[O-] ZINC000492039871 1042542764 /nfs/dbraw/zinc/54/27/64/1042542764.db2.gz DELCODLVWMUKRR-UHFFFAOYSA-N 1 1 343.408 4.336 20 5 EIBDMO CCOc1cc(C[N@H+](C)[C@@H](C)c2ccccc2F)ccc1[N+](=O)[O-] ZINC000492359292 1042623520 /nfs/dbraw/zinc/62/35/20/1042623520.db2.gz WLLWEQSBZCQUMF-ZDUSSCGKSA-N 1 1 332.375 4.326 20 5 EIBDMO CCOc1cc(C[N@@H+](C)[C@@H](C)c2ccccc2F)ccc1[N+](=O)[O-] ZINC000492359292 1042623535 /nfs/dbraw/zinc/62/35/35/1042623535.db2.gz WLLWEQSBZCQUMF-ZDUSSCGKSA-N 1 1 332.375 4.326 20 5 EIBDMO CCOc1cc(C[N@H+](C)[C@@H](C)c2sc(C)nc2C)ccc1[N+](=O)[O-] ZINC000492626976 1042713098 /nfs/dbraw/zinc/71/30/98/1042713098.db2.gz BXBXNEOFJDAWDH-LBPRGKRZSA-N 1 1 349.456 4.260 20 5 EIBDMO CCOc1cc(C[N@@H+](C)[C@@H](C)c2sc(C)nc2C)ccc1[N+](=O)[O-] ZINC000492626976 1042713104 /nfs/dbraw/zinc/71/31/04/1042713104.db2.gz BXBXNEOFJDAWDH-LBPRGKRZSA-N 1 1 349.456 4.260 20 5 EIBDMO CC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@H](C)Cc1ccsc1 ZINC000426478699 1042755973 /nfs/dbraw/zinc/75/59/73/1042755973.db2.gz FEBQFQDVTDYCIE-CYBMUJFWSA-N 1 1 334.441 4.118 20 5 EIBDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761512406 1042873762 /nfs/dbraw/zinc/87/37/62/1042873762.db2.gz SVERNGPGJCMVSV-GFCCVEGCSA-N 1 1 334.803 4.017 20 5 EIBDMO CCCC[C@@H](C)[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000554959978 1043167988 /nfs/dbraw/zinc/16/79/88/1043167988.db2.gz FFYXWNFDZQHBCW-CQSZACIVSA-N 1 1 331.416 4.303 20 5 EIBDMO Cc1cc(N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c(Cl)cc1[N+](=O)[O-] ZINC000301769484 1043347819 /nfs/dbraw/zinc/34/78/19/1043347819.db2.gz INTCUQBYEXMJKZ-BBRMVZONSA-N 1 1 349.862 4.010 20 5 EIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+](CCC(F)(F)F)CC1CC1 ZINC000255502084 1043530699 /nfs/dbraw/zinc/53/06/99/1043530699.db2.gz ZWKLKFRHIBEHNV-HYXAFXHYSA-N 1 1 328.334 4.272 20 5 EIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000732212947 1043886330 /nfs/dbraw/zinc/88/63/30/1043886330.db2.gz VKYWDZOOGBICPI-CYBMUJFWSA-N 1 1 334.778 4.377 20 5 EIBDMO C[C@H]([NH2+][C@H](CN1CCCC1)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000173304458 1043889639 /nfs/dbraw/zinc/88/96/39/1043889639.db2.gz QJSUSTJRRAKPFE-OXJNMPFZSA-N 1 1 339.439 4.083 20 5 EIBDMO Cc1nn(C)c(C)c1[C@@H]1CCC[N@@H+]1[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000245531635 1043971070 /nfs/dbraw/zinc/97/10/70/1043971070.db2.gz TZTUQCMZKUJFAI-KSSFIOAISA-N 1 1 342.443 4.152 20 5 EIBDMO Cn1c2ccc(Nc3ncc(Cl)cc3[N+](=O)[O-])cc2[nH+]c1C1CC1 ZINC000301893581 1043998929 /nfs/dbraw/zinc/99/89/29/1043998929.db2.gz WKULADXJFJBMMX-UHFFFAOYSA-N 1 1 343.774 4.151 20 5 EIBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ncc(C(C)(C)C)s1 ZINC000521941639 1044094067 /nfs/dbraw/zinc/09/40/67/1044094067.db2.gz BKTYNLVNUXFUJR-UHFFFAOYSA-N 1 1 333.457 4.023 20 5 EIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ncc(C(C)(C)C)s1 ZINC000521941639 1044094082 /nfs/dbraw/zinc/09/40/82/1044094082.db2.gz BKTYNLVNUXFUJR-UHFFFAOYSA-N 1 1 333.457 4.023 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C1(c3ccccc3F)CC1)CCC2 ZINC000193093020 1044514440 /nfs/dbraw/zinc/51/44/40/1044514440.db2.gz BDADFVPUIJIFOF-SFHVURJKSA-N 1 1 326.371 4.390 20 5 EIBDMO Cc1cc(N[C@H]2CC[N@H+](C)[C@@H]2c2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000301970628 1044528562 /nfs/dbraw/zinc/52/85/62/1044528562.db2.gz DVXYYXGKLROEEG-FUHWJXTLSA-N 1 1 347.365 4.039 20 5 EIBDMO COc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c(Cl)c1 ZINC000466472760 1044575248 /nfs/dbraw/zinc/57/52/48/1044575248.db2.gz HYOXMRFEVQZIKS-UHFFFAOYSA-N 1 1 341.194 4.200 20 5 EIBDMO C[C@@H](c1ccc2ccccc2c1)[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000543480452 1044692209 /nfs/dbraw/zinc/69/22/09/1044692209.db2.gz MRBGMMGBLOJGIU-AWEZNQCLSA-N 1 1 333.391 4.262 20 5 EIBDMO C[C@@H](c1ccc2ccccc2c1)[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000543480452 1044692212 /nfs/dbraw/zinc/69/22/12/1044692212.db2.gz MRBGMMGBLOJGIU-AWEZNQCLSA-N 1 1 333.391 4.262 20 5 EIBDMO C[C@@H]([NH2+]Cc1nc2ccc(F)cc2s1)c1cccc([N+](=O)[O-])c1 ZINC000428858215 1044742888 /nfs/dbraw/zinc/74/28/88/1044742888.db2.gz WQYJGUNPMZKDCY-SNVBAGLBSA-N 1 1 331.372 4.194 20 5 EIBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)[C@@H]1CCc2ccccc2C1 ZINC000735493241 1044831847 /nfs/dbraw/zinc/83/18/47/1044831847.db2.gz NPFYWAZFRUDICN-MRXNPFEDSA-N 1 1 330.815 4.238 20 5 EIBDMO CC[N@H+](Cc1ccc(OC)cc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000735491991 1044832431 /nfs/dbraw/zinc/83/24/31/1044832431.db2.gz RXNXHHVZMAPZIW-UHFFFAOYSA-N 1 1 334.803 4.279 20 5 EIBDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000735491991 1044832436 /nfs/dbraw/zinc/83/24/36/1044832436.db2.gz RXNXHHVZMAPZIW-UHFFFAOYSA-N 1 1 334.803 4.279 20 5 EIBDMO C[C@@H]([NH2+][C@H](CN(C)C)c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000555226025 1044836187 /nfs/dbraw/zinc/83/61/87/1044836187.db2.gz OPBUFTQMRNSYKT-FZKQIMNGSA-N 1 1 347.846 4.202 20 5 EIBDMO C[C@H]1SCC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H]1C ZINC000093499631 1044839856 /nfs/dbraw/zinc/83/98/56/1044839856.db2.gz VAGYNJWDYAGNKU-NWDGAFQWSA-N 1 1 349.481 4.044 20 5 EIBDMO C[C@H]1SCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H]1C ZINC000093499631 1044839857 /nfs/dbraw/zinc/83/98/57/1044839857.db2.gz VAGYNJWDYAGNKU-NWDGAFQWSA-N 1 1 349.481 4.044 20 5 EIBDMO Cc1nn(C[N@H+]2CCC[C@H](C)[C@@H]2c2ccc(C)cc2)c(C)c1[N+](=O)[O-] ZINC000738284645 1045049302 /nfs/dbraw/zinc/04/93/02/1045049302.db2.gz MXGUXHQZFHGNBE-KBXCAEBGSA-N 1 1 342.443 4.147 20 5 EIBDMO Cc1nn(C[N@@H+]2CCC[C@H](C)[C@@H]2c2ccc(C)cc2)c(C)c1[N+](=O)[O-] ZINC000738284645 1045049316 /nfs/dbraw/zinc/04/93/16/1045049316.db2.gz MXGUXHQZFHGNBE-KBXCAEBGSA-N 1 1 342.443 4.147 20 5 EIBDMO Cc1ccccc1[C@@H]1C[C@@H](C)[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000738312442 1045055619 /nfs/dbraw/zinc/05/56/19/1045055619.db2.gz OKNJWKLHEWEJSU-HUUCEWRRSA-N 1 1 328.387 4.420 20 5 EIBDMO CCC[C@H](NC[C@@H]1CCC[N@@H+](C(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000125868315 1045065124 /nfs/dbraw/zinc/06/51/24/1045065124.db2.gz JAKAEPBKCGJXHA-LPHOPBHVSA-N 1 1 333.476 4.146 20 5 EIBDMO CCC[C@H](NC[C@@H]1CCC[N@H+](C(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000125868315 1045065139 /nfs/dbraw/zinc/06/51/39/1045065139.db2.gz JAKAEPBKCGJXHA-LPHOPBHVSA-N 1 1 333.476 4.146 20 5 EIBDMO C[C@@H]1C[C@H](Nc2sccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000302032189 1045156053 /nfs/dbraw/zinc/15/60/53/1045156053.db2.gz SMYYEOQBLLEENJ-UKRRQHHQSA-N 1 1 331.441 4.121 20 5 EIBDMO C[C@@H](Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000302050100 1045157915 /nfs/dbraw/zinc/15/79/15/1045157915.db2.gz NKPAGNJGCMKITL-CHWSQXEVSA-N 1 1 337.851 4.313 20 5 EIBDMO CCOc1cc(N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)ccc1[N+](=O)[O-] ZINC000302067151 1045159277 /nfs/dbraw/zinc/15/92/77/1045159277.db2.gz WODZTVBPCLTOBV-LSDHHAIUSA-N 1 1 347.459 4.058 20 5 EIBDMO Cc1c(C[N@H+](Cc2ccc(F)cc2)CC2CC2)cccc1[N+](=O)[O-] ZINC000302937884 1045209787 /nfs/dbraw/zinc/20/97/87/1045209787.db2.gz AWQNMPLVIHFCGI-UHFFFAOYSA-N 1 1 328.387 4.455 20 5 EIBDMO CCOc1ccc([C@H](C)[NH2+]Cc2cc(C)cc(Cl)n2)cc1[N+](=O)[O-] ZINC000282437462 1045235682 /nfs/dbraw/zinc/23/56/82/1045235682.db2.gz DPDNVOAPZSNFFS-LBPRGKRZSA-N 1 1 349.818 4.201 20 5 EIBDMO CC[N@H+](Cc1ccoc1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000611267963 1045270749 /nfs/dbraw/zinc/27/07/49/1045270749.db2.gz YCACKEJLKZVPTA-UHFFFAOYSA-N 1 1 326.352 4.470 20 5 EIBDMO Cc1ccc(C[N@H+]2CCS[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000611271995 1045271605 /nfs/dbraw/zinc/27/16/05/1045271605.db2.gz FJLGHOJMMYMVMZ-SFHVURJKSA-N 1 1 328.437 4.193 20 5 EIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000611268263 1045271932 /nfs/dbraw/zinc/27/19/32/1045271932.db2.gz DXBPAWNVBIKVBN-OJWOGGGRSA-N 1 1 338.407 4.072 20 5 EIBDMO C[C@@H]1CCC[N@@H+](CCCCNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000301116983 1045814780 /nfs/dbraw/zinc/81/47/80/1045814780.db2.gz URDZPBYOMMKASN-OAHLLOKOSA-N 1 1 342.443 4.067 20 5 EIBDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000768541162 1045818131 /nfs/dbraw/zinc/81/81/31/1045818131.db2.gz FHRYVCOIQNYFET-UHFFFAOYSA-N 1 1 334.803 4.279 20 5 EIBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000768548858 1045822270 /nfs/dbraw/zinc/82/22/70/1045822270.db2.gz ILAXJXXZGYKKJD-QWHCGFSZSA-N 1 1 328.865 4.354 20 5 EIBDMO C[C@H]1CCCC[N@H+]1CCCCNc1ccc([N+](=O)[O-])c2cnccc12 ZINC000301121239 1045895590 /nfs/dbraw/zinc/89/55/90/1045895590.db2.gz XCXRGUSQDYNXQS-HNNXBMFYSA-N 1 1 342.443 4.210 20 5 EIBDMO CO[C@]1(C(F)(F)F)CCC[N@@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000614923789 1045944686 /nfs/dbraw/zinc/94/46/86/1045944686.db2.gz FQEZPOUUSOYVQN-SWLSCSKDSA-N 1 1 346.349 4.008 20 5 EIBDMO CO[C@]1(C(F)(F)F)CCC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000614923789 1045944699 /nfs/dbraw/zinc/94/46/99/1045944699.db2.gz FQEZPOUUSOYVQN-SWLSCSKDSA-N 1 1 346.349 4.008 20 5 EIBDMO C[N@@H+](CCN1CCCC1=O)Cc1c2ccccc2cc2ccccc21 ZINC000769391101 1045947809 /nfs/dbraw/zinc/94/78/09/1045947809.db2.gz YEDCGFYXUFYYKZ-UHFFFAOYSA-N 1 1 332.447 4.047 20 5 EIBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001170327157 1045999766 /nfs/dbraw/zinc/99/97/66/1045999766.db2.gz FFELGILYTVCCJR-MAUKXSAKSA-N 1 1 340.423 4.024 20 5 EIBDMO COc1ccc(C[C@@H](C)[N@H+]2CCc3ccccc3[C@H]2C)c([N+](=O)[O-])c1 ZINC001170327244 1046000349 /nfs/dbraw/zinc/00/03/49/1046000349.db2.gz GILACEBAQFNVAX-HUUCEWRRSA-N 1 1 340.423 4.154 20 5 EIBDMO COc1ccc(C[C@H](C)[N@@H+](C)CCCc2ccccc2)c([N+](=O)[O-])c1 ZINC001170346541 1046021544 /nfs/dbraw/zinc/02/15/44/1046021544.db2.gz OBOZIJUZLJTNKF-INIZCTEOSA-N 1 1 342.439 4.099 20 5 EIBDMO CC[N@@H+](Cc1cccs1)[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170350930 1046023698 /nfs/dbraw/zinc/02/36/98/1046023698.db2.gz CRVWYOJVGVWDHE-CYBMUJFWSA-N 1 1 334.441 4.118 20 5 EIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000536676556 1046661828 /nfs/dbraw/zinc/66/18/28/1046661828.db2.gz SEZQKLSYTZQROJ-MTIYJEKLSA-N 1 1 330.428 4.032 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H]1c1cc(C)on1 ZINC000787405950 1047005714 /nfs/dbraw/zinc/00/57/14/1047005714.db2.gz IVSAYAPLSPULEE-FUNAXGEOSA-N 1 1 327.384 4.132 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H]1c1cc(C)on1 ZINC000787405950 1047005732 /nfs/dbraw/zinc/00/57/32/1047005732.db2.gz IVSAYAPLSPULEE-FUNAXGEOSA-N 1 1 327.384 4.132 20 5 EIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@H]1Cc1ccc(F)cc1 ZINC000917831926 1047160249 /nfs/dbraw/zinc/16/02/49/1047160249.db2.gz VGUSJMKORAUPDD-KRWDZBQOSA-N 1 1 332.350 4.080 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCc3nc(Cl)ccc32)c1 ZINC000806146864 1047170657 /nfs/dbraw/zinc/17/06/57/1047170657.db2.gz DMHHWIBYBAECFW-CYBMUJFWSA-N 1 1 338.194 4.074 20 5 EIBDMO C[C@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788502220 1047206347 /nfs/dbraw/zinc/20/63/47/1047206347.db2.gz ICFNGNNWWXCHFS-VBKZILBWSA-N 1 1 348.406 4.012 20 5 EIBDMO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788665089 1047264760 /nfs/dbraw/zinc/26/47/60/1047264760.db2.gz MFHBSRVXOAQVFU-UWVGGRQHSA-N 1 1 337.782 4.381 20 5 EIBDMO COc1ccccc1[C@H]1CCCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000609281039 1047476207 /nfs/dbraw/zinc/47/62/07/1047476207.db2.gz ZIJXZCGZIZJAQO-GOSISDBHSA-N 1 1 326.396 4.331 20 5 EIBDMO C[C@H](N[C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000556132943 1047484080 /nfs/dbraw/zinc/48/40/80/1047484080.db2.gz UWVFVPMGONKCTR-XAUMDUMWSA-N 1 1 339.439 4.081 20 5 EIBDMO C[C@H]([NH2+][C@@H]1CCN(C)[C@@H](c2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000556132943 1047484086 /nfs/dbraw/zinc/48/40/86/1047484086.db2.gz UWVFVPMGONKCTR-XAUMDUMWSA-N 1 1 339.439 4.081 20 5 EIBDMO COc1ccc([C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])c2ccccc2)cc1 ZINC000194809042 1047746860 /nfs/dbraw/zinc/74/68/60/1047746860.db2.gz OEQLVQWCKJMAIG-NRFANRHFSA-N 1 1 348.402 4.483 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCc1c(F)cccc1F)C1CC1 ZINC001168310581 1047816416 /nfs/dbraw/zinc/81/64/16/1047816416.db2.gz VSPFBILRMYNWTA-UHFFFAOYSA-N 1 1 332.350 4.080 20 5 EIBDMO CC[C@@H](c1ccccc1OC)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC001170770063 1048220946 /nfs/dbraw/zinc/22/09/46/1048220946.db2.gz XTYCDPXTVYKCMS-SFHVURJKSA-N 1 1 328.412 4.229 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844436973 1048337662 /nfs/dbraw/zinc/33/76/62/1048337662.db2.gz JVPSVNOLHLNGJY-MRXNPFEDSA-N 1 1 340.370 4.003 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1c(F)cc(F)cc1F ZINC000815152748 1048350212 /nfs/dbraw/zinc/35/02/12/1048350212.db2.gz UXTQHSVLSANNGB-VZUCSPMQSA-N 1 1 336.313 4.205 20 5 EIBDMO CC(C)C[C@H]1CCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000557030343 1048408606 /nfs/dbraw/zinc/40/86/06/1048408606.db2.gz LUVOTZGBPLILRJ-MRXNPFEDSA-N 1 1 343.427 4.303 20 5 EIBDMO CSc1cccc(F)c1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809689809 1048456249 /nfs/dbraw/zinc/45/62/49/1048456249.db2.gz UXELWNDOYKBNPX-UHFFFAOYSA-N 1 1 340.807 4.399 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc(O)cc2)CC2CC2)cc1Cl ZINC000809737461 1048508897 /nfs/dbraw/zinc/50/88/97/1048508897.db2.gz ICBNEJVLYSGAFD-UHFFFAOYSA-N 1 1 346.814 4.366 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+](Cc1ccc(O)cc1)CC1CC1 ZINC000809737936 1048509815 /nfs/dbraw/zinc/50/98/15/1048509815.db2.gz MSSPJWYVNGTJKA-UHFFFAOYSA-N 1 1 346.814 4.366 20 5 EIBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]Cc1cccc(F)c1 ZINC000811473296 1049093303 /nfs/dbraw/zinc/09/33/03/1049093303.db2.gz VDRIHPZBIORHNK-UHFFFAOYSA-N 1 1 329.158 4.331 20 5 EIBDMO C[C@H]([NH2+]Cc1ccnc(Cl)c1Cl)c1cccc([N+](=O)[O-])c1 ZINC000811474941 1049096590 /nfs/dbraw/zinc/09/65/90/1049096590.db2.gz UHSQQYBEVYFMIW-VIFPVBQESA-N 1 1 326.183 4.147 20 5 EIBDMO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000609706150 1049280113 /nfs/dbraw/zinc/28/01/13/1049280113.db2.gz GRPOYJPVBGLUMQ-MRXNPFEDSA-N 1 1 348.443 4.110 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@H]1COc1ccccc1 ZINC001170648529 1049315932 /nfs/dbraw/zinc/31/59/32/1049315932.db2.gz ABOBUTDBQUXJDN-INIZCTEOSA-N 1 1 346.814 4.292 20 5 EIBDMO C[C@H]1C[C@H](N(C)c2ccccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000609964759 1049421133 /nfs/dbraw/zinc/42/11/33/1049421133.db2.gz CRZSZTJZKADTMR-FUHWJXTLSA-N 1 1 339.439 4.084 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])CCc2ccc(F)cc21 ZINC001171671576 1049774110 /nfs/dbraw/zinc/77/41/10/1049774110.db2.gz XPXRCBPKMNPJNC-GFCCVEGCSA-N 1 1 332.350 4.035 20 5 EIBDMO C[C@H]1C[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])CCc2ccc(F)cc21 ZINC001171671577 1049775459 /nfs/dbraw/zinc/77/54/59/1049775459.db2.gz XPXRCBPKMNPJNC-LBPRGKRZSA-N 1 1 332.350 4.035 20 5 EIBDMO C[C@]1(c2cccc(F)c2)CC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001171771791 1049793646 /nfs/dbraw/zinc/79/36/46/1049793646.db2.gz IVJOGDOMLQGULP-SFHVURJKSA-N 1 1 332.350 4.037 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH+]3CCC(C4CCCCC4)CC3)nc2c1 ZINC001171778846 1049797623 /nfs/dbraw/zinc/79/76/23/1049797623.db2.gz QLXLDFPJYLNRPK-UHFFFAOYSA-N 1 1 342.443 4.263 20 5 EIBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC(C)(C)CC(C)(C)C1 ZINC001171882266 1049815375 /nfs/dbraw/zinc/81/53/75/1049815375.db2.gz NFKNVOQTEICEBF-CQSZACIVSA-N 1 1 347.459 4.070 20 5 EIBDMO CC(C)([NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1[N+](=O)[O-] ZINC000813792881 1049818542 /nfs/dbraw/zinc/81/85/42/1049818542.db2.gz XZNHOXAZWWEQGI-UHFFFAOYSA-N 1 1 349.774 4.181 20 5 EIBDMO COc1ccccc1[C@H]1CCC[N@H+]1[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173228385 1050356408 /nfs/dbraw/zinc/35/64/08/1050356408.db2.gz VUBKVNUUGZEYHH-HNAYVOBHSA-N 1 1 340.423 4.372 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCSC[C@@H]1c1ccccc1 ZINC001173228399 1050357797 /nfs/dbraw/zinc/35/77/97/1050357797.db2.gz VWJRYGBONXNMDD-HNAYVOBHSA-N 1 1 342.464 4.316 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2c3ccccc3oc2C1 ZINC001173232679 1050359161 /nfs/dbraw/zinc/35/91/61/1050359161.db2.gz SGDAMZYNZMKYGQ-AWEZNQCLSA-N 1 1 336.391 4.330 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2c3ccccc3oc2C1 ZINC001173232679 1050359173 /nfs/dbraw/zinc/35/91/73/1050359173.db2.gz SGDAMZYNZMKYGQ-AWEZNQCLSA-N 1 1 336.391 4.330 20 5 EIBDMO CC[N@@H+](Cc1cccc(F)c1F)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173233673 1050362710 /nfs/dbraw/zinc/36/27/10/1050362710.db2.gz XXEKTEDKCUDVMZ-ZDUSSCGKSA-N 1 1 334.366 4.326 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1COc3c1cccc3Cl)CCC2 ZINC000618572019 1050413823 /nfs/dbraw/zinc/41/38/23/1050413823.db2.gz IJVSWVOZXSNTBN-IAGOWNOFSA-N 1 1 344.798 4.349 20 5 EIBDMO CCOc1ccc([C@H](C)[NH2+]C2(c3ccccc3F)CC2)cc1[N+](=O)[O-] ZINC000182236012 1050557580 /nfs/dbraw/zinc/55/75/80/1050557580.db2.gz VRDFOCKYKJEJMA-ZDUSSCGKSA-N 1 1 344.386 4.473 20 5 EIBDMO C[C@H]1CCC[C@H]([N@@H+](C)Cc2cc(Br)c([N+](=O)[O-])s2)C1 ZINC001180392497 1050975782 /nfs/dbraw/zinc/97/57/82/1050975782.db2.gz FPRADFOEGBMSFJ-UWVGGRQHSA-N 1 1 347.278 4.429 20 5 EIBDMO CCC[N@@H+](CC1CCCCC1)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC001190484871 1051187601 /nfs/dbraw/zinc/18/76/01/1051187601.db2.gz DJPHRCGUUYWXBN-OAHLLOKOSA-N 1 1 347.459 4.214 20 5 EIBDMO C[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000183710959 1051309847 /nfs/dbraw/zinc/30/98/47/1051309847.db2.gz BBDHNQQGUUCTSM-CQSZACIVSA-N 1 1 337.379 4.443 20 5 EIBDMO COc1cc(C[NH+]2CCC(C3CCCC3)CC2)c([N+](=O)[O-])cc1F ZINC001191350643 1051426494 /nfs/dbraw/zinc/42/64/94/1051426494.db2.gz PAYLNMNVYLXYKJ-UHFFFAOYSA-N 1 1 336.407 4.145 20 5 EIBDMO CCC(CC)[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)CC(C)C ZINC001191375915 1051447594 /nfs/dbraw/zinc/44/75/94/1051447594.db2.gz ZDFSGYJHAXKKAW-UHFFFAOYSA-N 1 1 349.475 4.378 20 5 EIBDMO CCC[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC001191985333 1051595120 /nfs/dbraw/zinc/59/51/20/1051595120.db2.gz AALDAGPFNSARPJ-GFCCVEGCSA-N 1 1 341.249 4.369 20 5 EIBDMO CCC1(CC)C[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])CCS1 ZINC001193129499 1051874904 /nfs/dbraw/zinc/87/49/04/1051874904.db2.gz CLSYAQBJDFTQRT-UHFFFAOYSA-N 1 1 328.865 4.356 20 5 EIBDMO CCC1(CC)C[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])CCS1 ZINC001193129499 1051874910 /nfs/dbraw/zinc/87/49/10/1051874910.db2.gz CLSYAQBJDFTQRT-UHFFFAOYSA-N 1 1 328.865 4.356 20 5 EIBDMO C[N@@H+](CCSCc1ccccc1)CCc1cccc([N+](=O)[O-])c1 ZINC001193743854 1051980947 /nfs/dbraw/zinc/98/09/47/1051980947.db2.gz VRRUQXSIKWUKOY-UHFFFAOYSA-N 1 1 330.453 4.003 20 5 EIBDMO Cc1ccc([C@@H]2C[C@H](C)[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)cc1 ZINC001193932529 1052023665 /nfs/dbraw/zinc/02/36/65/1052023665.db2.gz PSXUOMQHMSMSTI-WMLDXEAASA-N 1 1 328.387 4.420 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(NCc2ccccc2C[N@H+](C)C(C)C)c1 ZINC001184829947 1052112194 /nfs/dbraw/zinc/11/21/94/1052112194.db2.gz IKKFSXNGUQGADN-UHFFFAOYSA-N 1 1 327.428 4.356 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](C[C@H]3C[C@@H]4[C@H](C3)C4(F)F)C2)cc1 ZINC001194478694 1052158295 /nfs/dbraw/zinc/15/82/95/1052158295.db2.gz WTNVXUKVCLQXCT-SDNTUTLCSA-N 1 1 336.382 4.066 20 5 EIBDMO CCC[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Br ZINC001176776773 1052189316 /nfs/dbraw/zinc/18/93/16/1052189316.db2.gz APJKDORKABDRFG-GFCCVEGCSA-N 1 1 327.222 4.122 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(C(=O)c2ccccc2)CC1 ZINC000075595891 1052357049 /nfs/dbraw/zinc/35/70/49/1052357049.db2.gz VCCWFLAKJCOTQI-OAHLLOKOSA-N 1 1 338.407 4.251 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@@H]3c3ccsc3)nc2c1 ZINC000083168624 1052841175 /nfs/dbraw/zinc/84/11/75/1052841175.db2.gz OBQLJXLHUUZCQU-CQSZACIVSA-N 1 1 329.381 4.135 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@H]3c3ccsc3)nc2c1 ZINC000083168624 1052841176 /nfs/dbraw/zinc/84/11/76/1052841176.db2.gz OBQLJXLHUUZCQU-CQSZACIVSA-N 1 1 329.381 4.135 20 5 EIBDMO CCOc1cc(C[N@@H+](C)[C@@H](C)Cc2cccc(F)c2)ccc1[N+](=O)[O-] ZINC001195013894 1053214958 /nfs/dbraw/zinc/21/49/58/1053214958.db2.gz MVMCNSCWAKKLJG-AWEZNQCLSA-N 1 1 346.402 4.196 20 5 EIBDMO Cc1c(C[N@H+]2CCC[C@H]2Cc2cc(F)ccc2F)cccc1[N+](=O)[O-] ZINC001195256802 1053349026 /nfs/dbraw/zinc/34/90/26/1053349026.db2.gz CQFKONKELBFJCU-KRWDZBQOSA-N 1 1 346.377 4.389 20 5 EIBDMO COc1cc(C[N@@H+](C)[C@H]2CCC[C@H]2C(C)(C)C)c([N+](=O)[O-])cc1F ZINC001195279895 1053357903 /nfs/dbraw/zinc/35/79/03/1053357903.db2.gz PNCQHIXZSQNDTQ-HIFRSBDPSA-N 1 1 338.423 4.389 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](c3ccccn3)C2)ccc1Cl ZINC000852086888 1053549664 /nfs/dbraw/zinc/54/96/64/1053549664.db2.gz WVYSLUSEPKGWIM-AWEZNQCLSA-N 1 1 331.803 4.023 20 5 EIBDMO C[C@H]([NH2+]Cc1ccc(OC(F)F)cc1F)c1ccc([N+](=O)[O-])cc1 ZINC000865581245 1053553672 /nfs/dbraw/zinc/55/36/72/1053553672.db2.gz KACDTHYYQIPFPY-JTQLQIEISA-N 1 1 340.301 4.186 20 5 EIBDMO Cc1ccc([C@@H]2CCCCC[N@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000776584730 1053561886 /nfs/dbraw/zinc/56/18/86/1053561886.db2.gz PKNBHDZLXTVBIS-ROUUACIJSA-N 1 1 344.411 4.147 20 5 EIBDMO Cc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000776589573 1053575158 /nfs/dbraw/zinc/57/51/58/1053575158.db2.gz TVGRDIUJXZRUHC-KKXDTOCCSA-N 1 1 344.411 4.003 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@@H]([C@@H]2CCCCO2)C1 ZINC000852594173 1053594694 /nfs/dbraw/zinc/59/46/94/1053594694.db2.gz AGQZIPXNMOTSDV-DYVFJYSZSA-N 1 1 338.835 4.029 20 5 EIBDMO CC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc([N+](=O)[O-])cc1Br ZINC001196262910 1053622333 /nfs/dbraw/zinc/62/23/33/1053622333.db2.gz KJFDQHIHVQXMPU-VGPLMAKISA-N 1 1 339.233 4.120 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)c1cc2cnccc2o1 ZINC000866623077 1053809909 /nfs/dbraw/zinc/80/99/09/1053809909.db2.gz ROJOJTSWCVKBKP-NWDGAFQWSA-N 1 1 341.367 4.156 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](C)c1cc2cnccc2o1 ZINC000866623079 1053810106 /nfs/dbraw/zinc/81/01/06/1053810106.db2.gz ROJOJTSWCVKBKP-VXGBXAGGSA-N 1 1 341.367 4.156 20 5 EIBDMO CC(C)[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCCCC1 ZINC000173280304 1053891585 /nfs/dbraw/zinc/89/15/85/1053891585.db2.gz VKENYUHUIXPRQG-UHFFFAOYSA-N 1 1 344.415 4.188 20 5 EIBDMO C[C@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H]1c1ccccc1 ZINC001197661423 1053963221 /nfs/dbraw/zinc/96/32/21/1053963221.db2.gz VOCSBYATLUUCDZ-ORAYPTAESA-N 1 1 336.395 4.054 20 5 EIBDMO C[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H]1c1ccccc1 ZINC001197661423 1053963230 /nfs/dbraw/zinc/96/32/30/1053963230.db2.gz VOCSBYATLUUCDZ-ORAYPTAESA-N 1 1 336.395 4.054 20 5 EIBDMO C[N@H+](Cc1ccsc1)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000122992989 1054070825 /nfs/dbraw/zinc/07/08/25/1054070825.db2.gz MZBBNTCDKLSROA-UHFFFAOYSA-N 1 1 341.230 4.051 20 5 EIBDMO C[N@@H+](Cc1ccsc1)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000122992989 1054070838 /nfs/dbraw/zinc/07/08/38/1054070838.db2.gz MZBBNTCDKLSROA-UHFFFAOYSA-N 1 1 341.230 4.051 20 5 EIBDMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1ccc([N+](=O)[O-])cc1Br ZINC001168570331 1054117171 /nfs/dbraw/zinc/11/71/71/1054117171.db2.gz MWWXAUHFUPBMIS-JQWIXIFHSA-N 1 1 327.222 4.120 20 5 EIBDMO C[N@H+]1CCC[C@H](CNc2cccc(F)c2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000301439317 1054169886 /nfs/dbraw/zinc/16/98/86/1054169886.db2.gz TVCWPBIXJZYKGN-WBMJQRKESA-N 1 1 349.431 4.290 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCCCC23CCCCCC3)cc1 ZINC001198741719 1054238648 /nfs/dbraw/zinc/23/86/48/1054238648.db2.gz JMYBJNVAVOBNQB-GOSISDBHSA-N 1 1 332.444 4.207 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCCCC23CCCCCC3)cc1 ZINC001198741720 1054240510 /nfs/dbraw/zinc/24/05/10/1054240510.db2.gz JMYBJNVAVOBNQB-SFHVURJKSA-N 1 1 332.444 4.207 20 5 EIBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(C(F)(F)F)nc1 ZINC000871935414 1054324881 /nfs/dbraw/zinc/32/48/81/1054324881.db2.gz XCKDIGZWTMXJTD-GHMZBOCLSA-N 1 1 339.317 4.420 20 5 EIBDMO CCOCc1ccccc1C[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872021237 1054334795 /nfs/dbraw/zinc/33/47/95/1054334795.db2.gz PDZHQIMAXZIFBO-ZDUSSCGKSA-N 1 1 332.375 4.121 20 5 EIBDMO C[C@H]([NH2+][C@H]1CSCc2ccccc21)c1c(F)cccc1[N+](=O)[O-] ZINC000872029530 1054345900 /nfs/dbraw/zinc/34/59/00/1054345900.db2.gz RGFNEPJJAKBNQN-NHYWBVRUSA-N 1 1 332.400 4.373 20 5 EIBDMO Cc1cccnc1[C@H]([NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])C(C)C ZINC000872034131 1054350219 /nfs/dbraw/zinc/35/02/19/1054350219.db2.gz IBBVMSWCNKLNDD-CXAGYDPISA-N 1 1 331.391 4.485 20 5 EIBDMO CC[N@@H+](C)Cc1cccc(CN[C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000872035768 1054352834 /nfs/dbraw/zinc/35/28/34/1054352834.db2.gz YSLLSFUYCAOSGR-AWEZNQCLSA-N 1 1 345.418 4.036 20 5 EIBDMO COC[C@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1SC)c1ccccc1 ZINC000872044850 1054359919 /nfs/dbraw/zinc/35/99/19/1054359919.db2.gz GFONPUSJXBCJGH-DYVFJYSZSA-N 1 1 346.452 4.355 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]Cc2ccc(F)cc2F)o1 ZINC001199850747 1054478686 /nfs/dbraw/zinc/47/86/86/1054478686.db2.gz KDTXUKRPLDQOAL-UHFFFAOYSA-N 1 1 344.317 4.423 20 5 EIBDMO CC(C)[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CCCCC1 ZINC000878230003 1055213905 /nfs/dbraw/zinc/21/39/05/1055213905.db2.gz CPYKHGBBSLVJKS-UHFFFAOYSA-N 1 1 344.415 4.188 20 5 EIBDMO C[C@@H](C1CCCCC1)[N@@H+](C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878522258 1055332573 /nfs/dbraw/zinc/33/25/73/1055332573.db2.gz MGJXVMUUOGLBEK-ZDUSSCGKSA-N 1 1 344.415 4.045 20 5 EIBDMO C[C@H](NC[C@H](c1ccccc1)[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000326784566 1055520390 /nfs/dbraw/zinc/52/03/90/1055520390.db2.gz VLOMTXCGWPJHDY-OXJNMPFZSA-N 1 1 339.439 4.083 20 5 EIBDMO Cc1c([C@H](C)[NH2+][C@@H]2CCCc3cn(C(C)C)nc32)cccc1[N+](=O)[O-] ZINC000765819035 1055560164 /nfs/dbraw/zinc/56/01/64/1055560164.db2.gz PZSGXHLNCWVHHI-WMLDXEAASA-N 1 1 342.443 4.409 20 5 EIBDMO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)CCC2 ZINC000765818783 1055565274 /nfs/dbraw/zinc/56/52/74/1055565274.db2.gz OOMJEIFVDLYEHG-GUYCJALGSA-N 1 1 328.416 4.100 20 5 EIBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273538505 1055921466 /nfs/dbraw/zinc/92/14/66/1055921466.db2.gz SOTFAEKNILFVLU-HKUYNNGSSA-N 1 1 344.386 4.086 20 5 EIBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273538506 1055921905 /nfs/dbraw/zinc/92/19/05/1055921905.db2.gz SOTFAEKNILFVLU-IEBWSBKVSA-N 1 1 344.386 4.086 20 5 EIBDMO CC[NH+](CC)Cc1nc(-c2c3ccccc3nc3ccccc32)no1 ZINC000624751194 1056048674 /nfs/dbraw/zinc/04/86/74/1056048674.db2.gz XYKYHDQLGYGTSV-UHFFFAOYSA-N 1 1 332.407 4.280 20 5 EIBDMO CC[C@@H](Cc1ccc(C)cc1)[N@@H+](CC)Cn1nc(C)c([N+](=O)[O-])c1C ZINC000742177408 1058548978 /nfs/dbraw/zinc/54/89/78/1058548978.db2.gz FKXHOOOCTJSYTQ-SFHVURJKSA-N 1 1 344.459 4.017 20 5 EIBDMO C[N@@H+](Cc1ccc(Oc2ccccc2)cc1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169037067 1060593793 /nfs/dbraw/zinc/59/37/93/1060593793.db2.gz IOWGFBKHAGBIPW-QZTJIDSGSA-N 1 1 340.423 4.356 20 5 EIBDMO C[N@H+](Cc1c(Br)cccc1[N+](=O)[O-])[C@@H]1CCC(C)(C)C1 ZINC001169944066 1061043373 /nfs/dbraw/zinc/04/33/73/1061043373.db2.gz YONUVNIXQSWJFM-LLVKDONJSA-N 1 1 341.249 4.368 20 5 EIBDMO C[N@@H+](Cc1c(Br)cccc1[N+](=O)[O-])[C@@H]1CCC(C)(C)C1 ZINC001169944066 1061043392 /nfs/dbraw/zinc/04/33/92/1061043392.db2.gz YONUVNIXQSWJFM-LLVKDONJSA-N 1 1 341.249 4.368 20 5 EIBDMO CC(C)C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCCC1 ZINC000532933754 1032402921 /nfs/dbraw/zinc/40/29/21/1032402921.db2.gz MFTUMMBODAPTQP-UHFFFAOYSA-N 1 1 344.415 4.045 20 5 EIBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC1CCCCC1 ZINC000533223016 1032550001 /nfs/dbraw/zinc/55/00/01/1032550001.db2.gz YRBDYIRQZQKTLC-UHFFFAOYSA-N 1 1 343.427 4.304 20 5 EIBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1CCCCCC1 ZINC000533215611 1032544702 /nfs/dbraw/zinc/54/47/02/1032544702.db2.gz ZOGBJHBUUHFHFR-UHFFFAOYSA-N 1 1 343.427 4.447 20 5 EIBDMO Cc1ccccc1[C@H]1C[N@H+](Cc2cccc([N+](=O)[O-])c2C)[C@H](C)CO1 ZINC000441436354 1032622073 /nfs/dbraw/zinc/62/20/73/1032622073.db2.gz GQTWKQZNIOIFEW-FOIQADDNSA-N 1 1 340.423 4.174 20 5 EIBDMO Cc1ccccc1[C@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2C)[C@H](C)CO1 ZINC000441436354 1032622080 /nfs/dbraw/zinc/62/20/80/1032622080.db2.gz GQTWKQZNIOIFEW-FOIQADDNSA-N 1 1 340.423 4.174 20 5 EIBDMO C[C@@H]1CCC[C@H](C)[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000533432023 1032757660 /nfs/dbraw/zinc/75/76/60/1032757660.db2.gz TZNRYTJPZWDBAJ-CABCVRRESA-N 1 1 343.427 4.303 20 5 EIBDMO CC[C@@H]1CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000533435602 1032762902 /nfs/dbraw/zinc/76/29/02/1032762902.db2.gz NGFTZAZYJQYHSH-OAHLLOKOSA-N 1 1 343.427 4.304 20 5 EIBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1coc2ccccc12 ZINC000339415456 1018856474 /nfs/dbraw/zinc/85/64/74/1018856474.db2.gz SMQRUHWTGZNZDK-UHFFFAOYSA-N 1 1 326.352 4.030 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)c1cc2ccccc2o1 ZINC000430214673 1019391636 /nfs/dbraw/zinc/39/16/36/1019391636.db2.gz CGINYOLRDSALPA-LBPRGKRZSA-N 1 1 326.352 4.200 20 5 EIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H]1CC1CCCCC1 ZINC001167251972 1020678973 /nfs/dbraw/zinc/67/89/73/1020678973.db2.gz PFHWBOZKJDJGAY-KRWDZBQOSA-N 1 1 332.444 4.408 20 5 EIBDMO CCC[C@H]([NH2+]Cc1nn(C)c2ccccc12)c1cccc([N+](=O)[O-])c1 ZINC000612829255 1021426943 /nfs/dbraw/zinc/42/69/43/1021426943.db2.gz MTTWYUZXHAGCBH-KRWDZBQOSA-N 1 1 338.411 4.113 20 5 EIBDMO CCC[C@@H]([NH2+]Cc1nn(C)c2ccccc12)c1cccc([N+](=O)[O-])c1 ZINC000612829257 1021427634 /nfs/dbraw/zinc/42/76/34/1021427634.db2.gz MTTWYUZXHAGCBH-QGZVFWFLSA-N 1 1 338.411 4.113 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCS[C@H](c2ccccc2)C1 ZINC000610369755 1021549261 /nfs/dbraw/zinc/54/92/61/1021549261.db2.gz SSJYTLQQDMOKQJ-KSSFIOAISA-N 1 1 328.437 4.446 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2ccc(F)cc2F)cc(C(F)(F)F)c1 ZINC000580270980 1021768135 /nfs/dbraw/zinc/76/81/35/1021768135.db2.gz YFSLGELAKHPTRB-UHFFFAOYSA-N 1 1 346.255 4.182 20 5 EIBDMO CC[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC001167377580 1021840351 /nfs/dbraw/zinc/84/03/51/1021840351.db2.gz VJOPQFOFTCGDSF-GFCCVEGCSA-N 1 1 341.249 4.369 20 5 EIBDMO COc1cccc(F)c1[C@H](C)[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000582191673 1021930458 /nfs/dbraw/zinc/93/04/58/1021930458.db2.gz GWKDEWAIJIQBED-XHDPSFHLSA-N 1 1 330.359 4.081 20 5 EIBDMO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccncc1)c1cccc([N+](=O)[O-])c1 ZINC000173980908 1021995466 /nfs/dbraw/zinc/99/54/66/1021995466.db2.gz UUXOIVXUMCFYKE-FOIQADDNSA-N 1 1 333.391 4.430 20 5 EIBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1CCC[C@H]2CCC[C@@H]21 ZINC001167437079 1022636509 /nfs/dbraw/zinc/63/65/09/1022636509.db2.gz BZJSFYLLCIABAC-RISCZKNCSA-N 1 1 339.233 4.122 20 5 EIBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CCC[C@H]2CCC[C@@H]21 ZINC001167437079 1022636518 /nfs/dbraw/zinc/63/65/18/1022636518.db2.gz BZJSFYLLCIABAC-RISCZKNCSA-N 1 1 339.233 4.122 20 5 EIBDMO CC[C@H](C)C[N@@H+](CC)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000177850398 1022643869 /nfs/dbraw/zinc/64/38/69/1022643869.db2.gz DKVNKPGFKLWGAG-AWEZNQCLSA-N 1 1 331.416 4.160 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC000180416681 1022650553 /nfs/dbraw/zinc/65/05/53/1022650553.db2.gz XRKAZONCMXBHKC-SNVBAGLBSA-N 1 1 335.747 4.007 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC23CCOCC3)s1 ZINC000365828773 1022974943 /nfs/dbraw/zinc/97/49/43/1022974943.db2.gz IIBWWZIPBGXYTD-UHFFFAOYSA-N 1 1 344.436 4.078 20 5 EIBDMO C[C@H]([NH2+]Cc1cnc(CC(F)(F)F)s1)c1ccccc1[N+](=O)[O-] ZINC000893278172 1023045006 /nfs/dbraw/zinc/04/50/06/1023045006.db2.gz BBPVIRWAKSGJBU-VIFPVBQESA-N 1 1 345.346 4.007 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1cnc(C3CC3)o1)CCCC2 ZINC000417324551 1023267585 /nfs/dbraw/zinc/26/75/85/1023267585.db2.gz AKEZZDINIWHLGC-QGZVFWFLSA-N 1 1 327.384 4.018 20 5 EIBDMO Cc1ccc(C[C@H](C)[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000610582218 1024134120 /nfs/dbraw/zinc/13/41/20/1024134120.db2.gz KNVRMVZSYZBNHT-AWEZNQCLSA-N 1 1 339.395 4.107 20 5 EIBDMO COc1cccc(NCc2ccccc2C[N@@H+](C)C(C)C)c1[N+](=O)[O-] ZINC000548445463 1024590755 /nfs/dbraw/zinc/59/07/55/1024590755.db2.gz NWXJGBWESULSKL-UHFFFAOYSA-N 1 1 343.427 4.056 20 5 EIBDMO CCOc1cc(C[NH2+]C2(c3nccs3)CCCC2)ccc1[N+](=O)[O-] ZINC000276876865 1024640207 /nfs/dbraw/zinc/64/02/07/1024640207.db2.gz ILBAVSPVZYSWOJ-UHFFFAOYSA-N 1 1 347.440 4.009 20 5 EIBDMO COc1cccc(Cl)c1C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000091062051 1024831193 /nfs/dbraw/zinc/83/11/93/1024831193.db2.gz DCKXXUMXOROCJA-LBPRGKRZSA-N 1 1 334.803 4.416 20 5 EIBDMO CCc1ccc([C@H](COC)[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)o1 ZINC000165261186 1025179664 /nfs/dbraw/zinc/17/96/64/1025179664.db2.gz UUDDCRDPKDRPQK-DYVFJYSZSA-N 1 1 332.400 4.097 20 5 EIBDMO C[N@H+]1CC[C@H](Nc2ccnc3c2cccc3[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000432334813 1025648348 /nfs/dbraw/zinc/64/83/48/1025648348.db2.gz KMEAXGYKCRHSSF-PXNSSMCTSA-N 1 1 348.406 4.000 20 5 EIBDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)C12CCCCC2 ZINC001167538877 1025995630 /nfs/dbraw/zinc/99/56/30/1025995630.db2.gz FZFMBAHHQMXZNR-MOPGFXCFSA-N 1 1 346.471 4.463 20 5 EIBDMO CC1(C)C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H]2CCC[C@@H]21 ZINC000550076123 1026017013 /nfs/dbraw/zinc/01/70/13/1026017013.db2.gz KWNOXLWFSJACMW-DLBZAZTESA-N 1 1 341.411 4.260 20 5 EIBDMO CC(C)Oc1cccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511082399 1026242375 /nfs/dbraw/zinc/24/23/75/1026242375.db2.gz RLTKYEMSTSULSP-UHFFFAOYSA-N 1 1 328.412 4.057 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)o1 ZINC000279432474 1026426213 /nfs/dbraw/zinc/42/62/13/1026426213.db2.gz GTUMLCXFSWJYNC-SNVBAGLBSA-N 1 1 328.290 4.366 20 5 EIBDMO Cc1cc(N[C@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000507001913 1026573158 /nfs/dbraw/zinc/57/31/58/1026573158.db2.gz MCRDMYKZWBJURT-QAPCUYQASA-N 1 1 325.412 4.151 20 5 EIBDMO COc1ccc2c(c1)CCC[C@H]2[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000507139539 1026659308 /nfs/dbraw/zinc/65/93/08/1026659308.db2.gz BYXRDXQNHWIJHM-MRXNPFEDSA-N 1 1 332.425 4.174 20 5 EIBDMO COc1ccc2c(c1)CCC[C@H]2[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000507139539 1026659316 /nfs/dbraw/zinc/65/93/16/1026659316.db2.gz BYXRDXQNHWIJHM-MRXNPFEDSA-N 1 1 332.425 4.174 20 5 EIBDMO C[N@@H+](Cc1cccc(-c2ccncc2)c1)Cc1ccccc1[N+](=O)[O-] ZINC000507156144 1026674650 /nfs/dbraw/zinc/67/46/50/1026674650.db2.gz RIQXVAXKQCFNRT-UHFFFAOYSA-N 1 1 333.391 4.289 20 5 EIBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1sccc1Br ZINC000050015621 1026680981 /nfs/dbraw/zinc/68/09/81/1026680981.db2.gz BLURLDOVTDMNFE-VIFPVBQESA-N 1 1 341.230 4.270 20 5 EIBDMO COc1ccc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1C ZINC000507187292 1026682353 /nfs/dbraw/zinc/68/23/53/1026682353.db2.gz JXPWEJALPZGDKV-UHFFFAOYSA-N 1 1 326.396 4.076 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1C ZINC000507187292 1026682362 /nfs/dbraw/zinc/68/23/62/1026682362.db2.gz JXPWEJALPZGDKV-UHFFFAOYSA-N 1 1 326.396 4.076 20 5 EIBDMO C[C@H]([NH2+]Cc1cccnc1OC1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000178644111 1027069624 /nfs/dbraw/zinc/06/96/24/1027069624.db2.gz KAINPDQJDGSXLF-AWEZNQCLSA-N 1 1 341.411 4.162 20 5 EIBDMO C[C@H]1[C@H](Cc2ccccc2)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC001167619969 1027374682 /nfs/dbraw/zinc/37/46/82/1027374682.db2.gz OGKUUKOJQZYGLV-HOCLYGCPSA-N 1 1 328.387 4.187 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc(Cl)c(F)c1 ZINC000544384704 1027433098 /nfs/dbraw/zinc/43/30/98/1027433098.db2.gz CPFCLBKYERIFGW-JTQLQIEISA-N 1 1 338.766 4.247 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@H]2CCCC[C@@H]12 ZINC000543907225 1027445056 /nfs/dbraw/zinc/44/50/56/1027445056.db2.gz XNOQVEVQOJNUSC-BVGQSLNGSA-N 1 1 341.411 4.260 20 5 EIBDMO COc1ccc(C[N@H+]2C[C@H](C)C[C@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000441353280 1027473342 /nfs/dbraw/zinc/47/33/42/1027473342.db2.gz YZIQWHZVAXRTHY-DYVFJYSZSA-N 1 1 344.386 4.326 20 5 EIBDMO CO[C@@]1(C)CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000475561913 1027612495 /nfs/dbraw/zinc/61/24/95/1027612495.db2.gz RRIBOENSMQOQKL-IBGZPJMESA-N 1 1 344.411 4.246 20 5 EIBDMO Cc1ccc([C@@H](C)[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c(C)c1 ZINC000444588041 1027882699 /nfs/dbraw/zinc/88/26/99/1027882699.db2.gz CZAIKBMTJYGWIY-CQSZACIVSA-N 1 1 338.411 4.281 20 5 EIBDMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c(C)c1 ZINC000444588041 1027882709 /nfs/dbraw/zinc/88/27/09/1027882709.db2.gz CZAIKBMTJYGWIY-CQSZACIVSA-N 1 1 338.411 4.281 20 5 EIBDMO Cc1ccccc1[C@@H]1C[C@@H](C)[N@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000523442075 1028117575 /nfs/dbraw/zinc/11/75/75/1028117575.db2.gz KDEPVSHEBMZMJP-IAGOWNOFSA-N 1 1 340.423 4.160 20 5 EIBDMO COc1ccc(C[N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)cc1[N+](=O)[O-] ZINC000523582853 1028247617 /nfs/dbraw/zinc/24/76/17/1028247617.db2.gz JMPQUSCATGYLNM-OAHLLOKOSA-N 1 1 346.814 4.246 20 5 EIBDMO Cc1nc(C(C)C)oc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000428463731 1029660458 /nfs/dbraw/zinc/66/04/58/1029660458.db2.gz PWBZKBOMSAQUTF-UHFFFAOYSA-N 1 1 331.416 4.425 20 5 EIBDMO Cc1nc(C(C)C)oc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000428463731 1029660466 /nfs/dbraw/zinc/66/04/66/1029660466.db2.gz PWBZKBOMSAQUTF-UHFFFAOYSA-N 1 1 331.416 4.425 20 5 EIBDMO COc1cc(C[N@@H+]2[C@H](C)[C@H](CC(F)(F)F)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000451146788 1030274555 /nfs/dbraw/zinc/27/45/55/1030274555.db2.gz NALIFICDDGZPDZ-LOWVWBTDSA-N 1 1 346.349 4.155 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3ccncc3Cl)C2)cc1 ZINC000451554096 1030572991 /nfs/dbraw/zinc/57/29/91/1030572991.db2.gz ZEZQWNJAFJGVEQ-CQSZACIVSA-N 1 1 331.803 4.023 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(Cl)cc2F)cc1Cl ZINC000783677409 1030587597 /nfs/dbraw/zinc/58/75/97/1030587597.db2.gz LVAFOEWRBHLPDB-UHFFFAOYSA-N 1 1 329.158 4.331 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H]2CCC2CCCCC2)cc1 ZINC001168174914 1030665896 /nfs/dbraw/zinc/66/58/96/1030665896.db2.gz JXDWLAPBXKLFOY-UYAOXDASSA-N 1 1 346.471 4.453 20 5 EIBDMO Cc1ncsc1C[N@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000179427293 1031060416 /nfs/dbraw/zinc/06/04/16/1031060416.db2.gz BMHRCHIYTDOCAX-UHFFFAOYSA-N 1 1 343.408 4.252 20 5 EIBDMO Cc1ncsc1C[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000179427293 1031060432 /nfs/dbraw/zinc/06/04/32/1031060432.db2.gz BMHRCHIYTDOCAX-UHFFFAOYSA-N 1 1 343.408 4.252 20 5 EIBDMO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000179530340 1031195328 /nfs/dbraw/zinc/19/53/28/1031195328.db2.gz IMDYXLPVWRRTPV-ZDUSSCGKSA-N 1 1 332.375 4.372 20 5 EIBDMO CC(C)Oc1cccc([C@H](C)[NH2+]Cc2cc(F)ccc2[N+](=O)[O-])c1 ZINC000179668357 1031256714 /nfs/dbraw/zinc/25/67/14/1031256714.db2.gz SKNAGRHEGCJXRK-ZDUSSCGKSA-N 1 1 332.375 4.372 20 5 EIBDMO C[C@H]([NH2+][C@@H]1CCc2cc(F)c(F)c(F)c21)c1cccc([N+](=O)[O-])c1 ZINC000449087643 1031449997 /nfs/dbraw/zinc/44/99/97/1031449997.db2.gz GTLASYYPSVKION-LKFCYVNXSA-N 1 1 336.313 4.350 20 5 EIBDMO COCCCCc1ccc[nH+]c1N[C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449336966 1031655889 /nfs/dbraw/zinc/65/58/89/1031655889.db2.gz PXQWZEFILDLUOO-OAHLLOKOSA-N 1 1 343.427 4.002 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3scnc3C3CC3)C2)cc1 ZINC000449499359 1031808341 /nfs/dbraw/zinc/80/83/41/1031808341.db2.gz LXAZLYQONDEGSM-HNNXBMFYSA-N 1 1 343.452 4.308 20 5 EIBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1(C)C ZINC000449503359 1031812753 /nfs/dbraw/zinc/81/27/53/1031812753.db2.gz TYHOYZMYRSATGK-GOSISDBHSA-N 1 1 344.411 4.102 20 5 EIBDMO CC1(C)C[C@H]([NH2+][C@@H]2COc3ccc(F)cc32)c2cc([N+](=O)[O-])ccc21 ZINC000433231537 1034079579 /nfs/dbraw/zinc/07/95/79/1034079579.db2.gz KKMGGEQTSAMAEA-DLBZAZTESA-N 1 1 342.370 4.180 20 5 EIBDMO COC[C@H]([NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccc(C)o1 ZINC000433293333 1034183014 /nfs/dbraw/zinc/18/30/14/1034183014.db2.gz DNCDXMKXUHZJMC-SJORKVTESA-N 1 1 344.411 4.196 20 5 EIBDMO C[C@@H]1CCSCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000483428330 1034522914 /nfs/dbraw/zinc/52/29/14/1034522914.db2.gz VNZDEDGRUNLJTH-CYBMUJFWSA-N 1 1 332.425 4.182 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(Cl)ccc2OCC2CC2)cc1 ZINC000430022980 1035013042 /nfs/dbraw/zinc/01/30/42/1035013042.db2.gz MKQTXXUFEQLYJC-UHFFFAOYSA-N 1 1 346.814 4.327 20 5 EIBDMO CCOCc1ccccc1C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000236989426 1035230214 /nfs/dbraw/zinc/23/02/14/1035230214.db2.gz VUVMZZMBOBLPNN-UHFFFAOYSA-N 1 1 334.803 4.075 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCCOc3c(Cl)cccc32)cs1 ZINC000345695092 1035282221 /nfs/dbraw/zinc/28/22/21/1035282221.db2.gz 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Cc1noc(C[N@H+]([C@H](C)c2ccccc2)C2CCCC2)c1[N+](=O)[O-] ZINC000595483697 1035680780 /nfs/dbraw/zinc/68/07/80/1035680780.db2.gz UUNWQSBMMCJXQU-CQSZACIVSA-N 1 1 329.400 4.397 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H]([C@H]2CCCCO2)C1 ZINC000595788864 1035792604 /nfs/dbraw/zinc/79/26/04/1035792604.db2.gz KGKPTHZTZVDFNS-RHSMWYFYSA-N 1 1 338.835 4.029 20 5 EIBDMO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@H](C)c1cccc(OC)c1 ZINC000491164577 1035820455 /nfs/dbraw/zinc/82/04/55/1035820455.db2.gz AVMLVOVWWYKSFF-CYBMUJFWSA-N 1 1 332.375 4.326 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@H](C)c1cccc(OC)c1 ZINC000491164577 1035820456 /nfs/dbraw/zinc/82/04/56/1035820456.db2.gz AVMLVOVWWYKSFF-CYBMUJFWSA-N 1 1 332.375 4.326 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)cc(Cl)c1N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000587837754 1036143390 /nfs/dbraw/zinc/14/33/90/1036143390.db2.gz DEEWFFOIJXQZPP-VIFPVBQESA-N 1 1 341.198 4.009 20 5 EIBDMO COc1ccc(C[N@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c(OC)c1 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ISQVKTZOXUCOKH-INIZCTEOSA-N 1 1 334.322 4.086 20 5 EIBDMO CC(C)O[C@H](C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1)c1ccccc1 ZINC000589988560 1036924626 /nfs/dbraw/zinc/92/46/26/1036924626.db2.gz OJMONFKOILAXLO-HXUWFJFHSA-N 1 1 340.423 4.119 20 5 EIBDMO Cc1cscc1C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000487174481 1037020694 /nfs/dbraw/zinc/02/06/94/1037020694.db2.gz XIYFWCFSRWISKL-UHFFFAOYSA-N 1 1 345.449 4.378 20 5 EIBDMO Cc1ccc(F)c(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000487173200 1037020822 /nfs/dbraw/zinc/02/08/22/1037020822.db2.gz NNSZUADSAXCSLG-UHFFFAOYSA-N 1 1 342.292 4.351 20 5 EIBDMO COc1ccc(C[N@H+](C)[C@H](C)c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000603856864 1037050926 /nfs/dbraw/zinc/05/09/26/1037050926.db2.gz YTMGRXYDCDFEQO-GFCCVEGCSA-N 1 1 334.803 4.450 20 5 EIBDMO COc1ccc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000603856864 1037050944 /nfs/dbraw/zinc/05/09/44/1037050944.db2.gz YTMGRXYDCDFEQO-GFCCVEGCSA-N 1 1 334.803 4.450 20 5 EIBDMO Cc1ccccc1[C@H]1CCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000603856936 1037052371 /nfs/dbraw/zinc/05/23/71/1037052371.db2.gz GDBUJQQFKQMRFZ-QGZVFWFLSA-N 1 1 326.396 4.119 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000604435663 1037389770 /nfs/dbraw/zinc/38/97/70/1037389770.db2.gz OGCNQGQXRWFBOU-SPYBWZPUSA-N 1 1 326.396 4.118 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000604435663 1037389789 /nfs/dbraw/zinc/38/97/89/1037389789.db2.gz OGCNQGQXRWFBOU-SPYBWZPUSA-N 1 1 326.396 4.118 20 5 EIBDMO COc1ccc(C[NH2+]Cc2ccc(-c3ccccc3)o2)cc1[N+](=O)[O-] ZINC000604473847 1037397427 /nfs/dbraw/zinc/39/74/27/1037397427.db2.gz ZHEVRGCBEOPBOA-UHFFFAOYSA-N 1 1 338.363 4.153 20 5 EIBDMO C[N@H+](Cc1csc([N+](=O)[O-])c1)C[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000604521435 1037399810 /nfs/dbraw/zinc/39/98/10/1037399810.db2.gz JVDCBKYWVGOWGK-WMZOPIPTSA-N 1 1 346.452 4.256 20 5 EIBDMO CCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(OC)cc1 ZINC000604492943 1037407815 /nfs/dbraw/zinc/40/78/15/1037407815.db2.gz DCBIFBHHORZXNL-UHFFFAOYSA-N 1 1 328.412 4.058 20 5 EIBDMO C[C@H](N[C@@H]1CCC[NH2+]CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000591578333 1037504786 /nfs/dbraw/zinc/50/47/86/1037504786.db2.gz RGEGGTAHJCQEHT-UONOGXRCSA-N 1 1 345.468 4.116 20 5 EIBDMO CC(C)c1ccc(C[NH2+][C@@H](CCO)c2ccccc2F)cc1[N+](=O)[O-] ZINC000592376402 1037780641 /nfs/dbraw/zinc/78/06/41/1037780641.db2.gz JJDYWVRGFQPKNY-SFHVURJKSA-N 1 1 346.402 4.071 20 5 EIBDMO CC(C)c1ccc(C[N@H+]2CC[C@H](c3cccnc3)C2)cc1[N+](=O)[O-] ZINC000592520033 1038139071 /nfs/dbraw/zinc/13/90/71/1038139071.db2.gz CFYMKWNBKHIJEF-KRWDZBQOSA-N 1 1 325.412 4.103 20 5 EIBDMO COc1ccc([C@@H]2CC[N@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000504519954 1038392772 /nfs/dbraw/zinc/39/27/72/1038392772.db2.gz BHJUEKPURFIZGB-WMLDXEAASA-N 1 1 326.396 4.154 20 5 EIBDMO CC[C@H]1CCCCC[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000537635905 1039363650 /nfs/dbraw/zinc/36/36/50/1039363650.db2.gz FKCZTCWDVCSZEE-KRWDZBQOSA-N 1 1 342.443 4.150 20 5 EIBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CC[C@H](c3ccccc3F)C2)c(F)c1 ZINC000555582598 1039402606 /nfs/dbraw/zinc/40/26/06/1039402606.db2.gz CPHARFNIBCWNQX-NSHDSACASA-N 1 1 336.313 4.002 20 5 EIBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CC[C@H](c3ccccc3F)C2)c(F)c1 ZINC000555582598 1039402626 /nfs/dbraw/zinc/40/26/26/1039402626.db2.gz CPHARFNIBCWNQX-NSHDSACASA-N 1 1 336.313 4.002 20 5 EIBDMO CC(C)[C@@H]1CCCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000534857158 1039826420 /nfs/dbraw/zinc/82/64/20/1039826420.db2.gz JPKSKYINVDVVRG-KRWDZBQOSA-N 1 1 329.400 4.260 20 5 EIBDMO C[C@@]12CC[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C[C@@H]1C2(F)F ZINC000430104254 1039836223 /nfs/dbraw/zinc/83/62/23/1039836223.db2.gz LTYMPDVCQPUQTP-DLBZAZTESA-N 1 1 348.349 4.332 20 5 EIBDMO CCc1ccc([C@@H](COC)[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)o1 ZINC000192899567 1039846701 /nfs/dbraw/zinc/84/67/01/1039846701.db2.gz ZOCZUQKNDJGBNZ-QZTJIDSGSA-N 1 1 344.411 4.105 20 5 EIBDMO [NH3+]C1(c2nc(-c3cc4ccccc4c4ccccc34)no2)CC(F)C1 ZINC001212121483 1039853457 /nfs/dbraw/zinc/85/34/57/1039853457.db2.gz CKKPKEXKMRVIQI-UHFFFAOYSA-N 1 1 333.366 4.329 20 5 EIBDMO COc1ccc([C@@H]2CCC[N@@H+]2Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000505608201 1040066501 /nfs/dbraw/zinc/06/65/01/1040066501.db2.gz KEBZYMHONDBAHJ-KRWDZBQOSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000505608201 1040066511 /nfs/dbraw/zinc/06/65/11/1040066511.db2.gz KEBZYMHONDBAHJ-KRWDZBQOSA-N 1 1 330.359 4.080 20 5 EIBDMO Cc1ccccc1[C@H]1CCC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482683216 1040429219 /nfs/dbraw/zinc/42/92/19/1040429219.db2.gz LNOSVOHGCRIIDT-GOSISDBHSA-N 1 1 336.395 4.117 20 5 EIBDMO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482683216 1040429227 /nfs/dbraw/zinc/42/92/27/1040429227.db2.gz LNOSVOHGCRIIDT-GOSISDBHSA-N 1 1 336.395 4.117 20 5 EIBDMO C[C@H](NC(C)(C)C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000482955520 1040602254 /nfs/dbraw/zinc/60/22/54/1040602254.db2.gz ZZAYZEOSRTVQAB-HOTGVXAUSA-N 1 1 341.455 4.375 20 5 EIBDMO CC(C)[N@@H+](C)CC(=O)N(C)Cc1c2ccccc2cc2ccccc21 ZINC001142586999 1041162308 /nfs/dbraw/zinc/16/23/08/1041162308.db2.gz YJTIXALNAFWYPU-UHFFFAOYSA-N 1 1 334.463 4.292 20 5 EIBDMO C[C@@H](Nc1cccc(CC[N@@H+](C)C2CC2)c1)c1ccccc1[N+](=O)[O-] ZINC000540337976 1041380757 /nfs/dbraw/zinc/38/07/57/1041380757.db2.gz NKPMZZNOWKBXOQ-OAHLLOKOSA-N 1 1 339.439 4.405 20 5 EIBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@H](C(F)(F)F)C3(CCC3)C2)cc1 ZINC000554846314 1041445140 /nfs/dbraw/zinc/44/51/40/1041445140.db2.gz SFANKRGVSMWMRH-HNNXBMFYSA-N 1 1 342.361 4.192 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](COc2ccccc2)C1 ZINC000505875181 1041457191 /nfs/dbraw/zinc/45/71/91/1041457191.db2.gz STBZYPJRBOGAES-SJORKVTESA-N 1 1 340.423 4.365 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463443939 1041569583 /nfs/dbraw/zinc/56/95/83/1041569583.db2.gz QBHDRWOMJYECLG-KGLIPLIRSA-N 1 1 346.349 4.156 20 5 EIBDMO COc1cc(C[N@H+](Cc2ccco2)C2CCCC2)c([N+](=O)[O-])cc1F ZINC000463488409 1041594307 /nfs/dbraw/zinc/59/43/07/1041594307.db2.gz CWKXJAZWWVUYJX-UHFFFAOYSA-N 1 1 348.374 4.280 20 5 EIBDMO COc1cc(C[N@@H+](Cc2ccco2)C2CCCC2)c([N+](=O)[O-])cc1F ZINC000463488409 1041594309 /nfs/dbraw/zinc/59/43/09/1041594309.db2.gz CWKXJAZWWVUYJX-UHFFFAOYSA-N 1 1 348.374 4.280 20 5 EIBDMO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@H](C)c1ccc(F)cc1 ZINC000516618076 1041677616 /nfs/dbraw/zinc/67/76/16/1041677616.db2.gz IIONYPYUUTVTOS-CYBMUJFWSA-N 1 1 332.375 4.326 20 5 EIBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@H](C)c1ccc(F)cc1 ZINC000516618076 1041677620 /nfs/dbraw/zinc/67/76/20/1041677620.db2.gz IIONYPYUUTVTOS-CYBMUJFWSA-N 1 1 332.375 4.326 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3ccccn3)C2)c(Cl)c1 ZINC000595502411 1041768615 /nfs/dbraw/zinc/76/86/15/1041768615.db2.gz UDBISKNNWCCAEN-CQSZACIVSA-N 1 1 331.803 4.023 20 5 EIBDMO Cn1cc(C[N@@H+](C)C2CCCCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000506141349 1041928228 /nfs/dbraw/zinc/92/82/28/1041928228.db2.gz UXIWWCISUOVQOA-UHFFFAOYSA-N 1 1 342.443 4.150 20 5 EIBDMO COc1cccc(F)c1[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000122462222 1042080499 /nfs/dbraw/zinc/08/04/99/1042080499.db2.gz YNUWVSBQQPXAII-STQMWFEESA-N 1 1 332.375 4.463 20 5 EIBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@H]1CCSC1 ZINC000506235573 1042182610 /nfs/dbraw/zinc/18/26/10/1042182610.db2.gz WLRLTQVQGXMZTD-AWEZNQCLSA-N 1 1 334.466 4.261 20 5 EIBDMO COc1ccc([C@H](C)[N@@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])cc1 ZINC000506325967 1042314948 /nfs/dbraw/zinc/31/49/48/1042314948.db2.gz OIYWPMHFIYRGIH-VFADXPBXSA-N 1 1 326.396 4.310 20 5 EIBDMO C[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C[C@H]1CC=CCC1 ZINC000542249347 1042360175 /nfs/dbraw/zinc/36/01/75/1042360175.db2.gz MQMRWFHTRJHUSB-AWEZNQCLSA-N 1 1 327.384 4.038 20 5 EIBDMO CC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@@H](C)c1cccc(O)c1 ZINC000509554945 1042364147 /nfs/dbraw/zinc/36/41/47/1042364147.db2.gz HYRFGWYQTAKLEN-XMELGKRDSA-N 1 1 326.396 4.397 20 5 EIBDMO C[C@@H]1C[C@@H]1c1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)o1 ZINC000030150808 1042492810 /nfs/dbraw/zinc/49/28/10/1042492810.db2.gz CKTASMDEKYBDTB-ACJLOTCBSA-N 1 1 326.396 4.476 20 5 EIBDMO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)o1 ZINC000030150808 1042492814 /nfs/dbraw/zinc/49/28/14/1042492814.db2.gz CKTASMDEKYBDTB-ACJLOTCBSA-N 1 1 326.396 4.476 20 5 EIBDMO COc1ccc(Cl)cc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000492051667 1042540896 /nfs/dbraw/zinc/54/08/96/1042540896.db2.gz WWJLHSXSTVJHFJ-UHFFFAOYSA-N 1 1 334.803 4.282 20 5 EIBDMO CC[C@H]([NH2+]C1(c2nc(C)cs2)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000271958395 1042565097 /nfs/dbraw/zinc/56/50/97/1042565097.db2.gz KTVBZVHTNWXYHF-HNNXBMFYSA-N 1 1 331.441 4.480 20 5 EIBDMO CSc1ccc([C@@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000439474167 1042646203 /nfs/dbraw/zinc/64/62/03/1042646203.db2.gz BVDPGFTVWQOEBE-LLVKDONJSA-N 1 1 343.408 4.309 20 5 EIBDMO CCOc1cc(C[N@@H+]2CCc3sccc3[C@@H]2C)ccc1[N+](=O)[O-] ZINC000492487869 1042674955 /nfs/dbraw/zinc/67/49/55/1042674955.db2.gz SJFGVWLZNPPZBS-LBPRGKRZSA-N 1 1 332.425 4.174 20 5 EIBDMO CCOc1cc(C[N@H+]2CCc3sccc3[C@@H]2C)ccc1[N+](=O)[O-] ZINC000492487869 1042674957 /nfs/dbraw/zinc/67/49/57/1042674957.db2.gz SJFGVWLZNPPZBS-LBPRGKRZSA-N 1 1 332.425 4.174 20 5 EIBDMO CC[C@H]([NH2+]Cc1cnc(C(F)(F)F)s1)c1cccc([N+](=O)[O-])c1 ZINC000443993634 1042729573 /nfs/dbraw/zinc/72/95/73/1042729573.db2.gz MOETYSQREIUDHV-LBPRGKRZSA-N 1 1 345.346 4.311 20 5 EIBDMO Cc1[nH+]ccn1CCCCNc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1 ZINC000152352506 1042769971 /nfs/dbraw/zinc/76/99/71/1042769971.db2.gz APJAJTKPGAILGC-UHFFFAOYSA-N 1 1 346.431 4.169 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248404294 1042824140 /nfs/dbraw/zinc/82/41/40/1042824140.db2.gz PXWRKSHUKXJITK-ULQDDVLXSA-N 1 1 345.487 4.207 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000248404294 1042824145 /nfs/dbraw/zinc/82/41/45/1042824145.db2.gz PXWRKSHUKXJITK-ULQDDVLXSA-N 1 1 345.487 4.207 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(Oc3ccccc3)CC2)cc1Cl ZINC000761507813 1042872221 /nfs/dbraw/zinc/87/22/21/1042872221.db2.gz XZICGZGOFPVVNH-UHFFFAOYSA-N 1 1 346.814 4.292 20 5 EIBDMO COc1ccc([C@H]2CC[N@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])C2)cc1 ZINC000441535013 1042878694 /nfs/dbraw/zinc/87/86/94/1042878694.db2.gz OKBOXZCWPPBQGD-HOCLYGCPSA-N 1 1 326.396 4.154 20 5 EIBDMO CCCC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000609193950 1043444822 /nfs/dbraw/zinc/44/48/22/1043444822.db2.gz MOWPDBTWHYEGMP-UHFFFAOYSA-N 1 1 329.400 4.057 20 5 EIBDMO Cc1ccccc1C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000609193312 1043445122 /nfs/dbraw/zinc/44/51/22/1043445122.db2.gz IBETUESMZMBCOB-UHFFFAOYSA-N 1 1 328.412 4.322 20 5 EIBDMO Cc1ccccc1C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000609193312 1043445130 /nfs/dbraw/zinc/44/51/30/1043445130.db2.gz IBETUESMZMBCOB-UHFFFAOYSA-N 1 1 328.412 4.322 20 5 EIBDMO Cc1c(C[N@@H+]2CCCC[C@@H]2[C@@H]2C[C@H](C)CC[C@H]2O)cccc1[N+](=O)[O-] ZINC000438993674 1043742125 /nfs/dbraw/zinc/74/21/25/1043742125.db2.gz ACUJEQHOLGEVQH-IXMYUCAJSA-N 1 1 346.471 4.055 20 5 EIBDMO C[C@@H](NCCC[NH2+]C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423532868 1043857832 /nfs/dbraw/zinc/85/78/32/1043857832.db2.gz WCCHWXHRQIFQCX-CYBMUJFWSA-N 1 1 345.468 4.116 20 5 EIBDMO CCC[N@H+](Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])CC(C)C ZINC000521819645 1044011155 /nfs/dbraw/zinc/01/11/55/1044011155.db2.gz DNTJVWQNZODOMI-UHFFFAOYSA-N 1 1 346.374 4.073 20 5 EIBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000732989712 1044062968 /nfs/dbraw/zinc/06/29/68/1044062968.db2.gz UGKIOYROHDLOSJ-INIZCTEOSA-N 1 1 348.349 4.089 20 5 EIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000732989712 1044062985 /nfs/dbraw/zinc/06/29/85/1044062985.db2.gz UGKIOYROHDLOSJ-INIZCTEOSA-N 1 1 348.349 4.089 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@H]4CCC[C@H]43)co2)cc1 ZINC000245918249 1044212310 /nfs/dbraw/zinc/21/23/10/1044212310.db2.gz SHHYSXSLWGOPJG-CXAGYDPISA-N 1 1 327.384 4.014 20 5 EIBDMO Cc1ccsc1C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000522197273 1044371313 /nfs/dbraw/zinc/37/13/13/1044371313.db2.gz YUEURCLZUGTFFJ-UHFFFAOYSA-N 1 1 345.449 4.378 20 5 EIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CC[C@@H](COc2ccccc2)C1 ZINC000494823339 1044396500 /nfs/dbraw/zinc/39/65/00/1044396500.db2.gz MHDOUZMYYHPJOL-CQSZACIVSA-N 1 1 346.814 4.149 20 5 EIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC[C@@H](COc2ccccc2)C1 ZINC000494823339 1044396516 /nfs/dbraw/zinc/39/65/16/1044396516.db2.gz MHDOUZMYYHPJOL-CQSZACIVSA-N 1 1 346.814 4.149 20 5 EIBDMO CCc1ccc([C@H]([NH2+]C[C@@H](OC)C(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543404228 1044524167 /nfs/dbraw/zinc/52/41/67/1044524167.db2.gz YKDJFLYJCSOXTG-RTBURBONSA-N 1 1 346.427 4.100 20 5 EIBDMO O=[N+]([O-])c1ccsc1NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000301977712 1044529580 /nfs/dbraw/zinc/52/95/80/1044529580.db2.gz DQPBUZVHADUVQQ-GFCCVEGCSA-N 1 1 337.470 4.042 20 5 EIBDMO C[C@H](C1CCCCC1)[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000282351751 1044532184 /nfs/dbraw/zinc/53/21/84/1044532184.db2.gz CQSUOKCJUDJULR-CYBMUJFWSA-N 1 1 344.415 4.045 20 5 EIBDMO Cc1cc(Cl)ccc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000466469999 1044570150 /nfs/dbraw/zinc/57/01/50/1044570150.db2.gz YFHQDORFJNGGBA-UHFFFAOYSA-N 1 1 325.195 4.500 20 5 EIBDMO C[C@@H](c1cccc2ccccc21)[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000543478995 1044689458 /nfs/dbraw/zinc/68/94/58/1044689458.db2.gz MRUOKMVRRXZHOF-AWEZNQCLSA-N 1 1 333.391 4.262 20 5 EIBDMO C[C@@H](c1cccc2ccccc21)[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000543478995 1044689467 /nfs/dbraw/zinc/68/94/67/1044689467.db2.gz MRUOKMVRRXZHOF-AWEZNQCLSA-N 1 1 333.391 4.262 20 5 EIBDMO C[C@H]([N@@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C1(C)CC1 ZINC000091900262 1044717226 /nfs/dbraw/zinc/71/72/26/1044717226.db2.gz GPURONKJNLGFIY-LBPRGKRZSA-N 1 1 331.441 4.339 20 5 EIBDMO COc1ccc([C@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)cc1 ZINC000735490931 1044823353 /nfs/dbraw/zinc/82/33/53/1044823353.db2.gz WADYKRHVKKPNNT-AWEZNQCLSA-N 1 1 346.814 4.246 20 5 EIBDMO COCC[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)[C@@H](C)c1ccccc1 ZINC000735490873 1044823409 /nfs/dbraw/zinc/82/34/09/1044823409.db2.gz TUZSHCHWZQBRJK-AWEZNQCLSA-N 1 1 348.830 4.458 20 5 EIBDMO COCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)[C@@H](C)c1ccccc1 ZINC000735490873 1044823410 /nfs/dbraw/zinc/82/34/10/1044823410.db2.gz TUZSHCHWZQBRJK-AWEZNQCLSA-N 1 1 348.830 4.458 20 5 EIBDMO CCc1onc(C)c1C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000922987643 1044889653 /nfs/dbraw/zinc/88/96/53/1044889653.db2.gz FOAQGOGYTHMFMP-UHFFFAOYSA-N 1 1 341.367 4.003 20 5 EIBDMO CC(C)O[C@@H](C[N@@H+](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000428967244 1044918225 /nfs/dbraw/zinc/91/82/25/1044918225.db2.gz MBUJIKYTQFIKJF-FQEVSTJZSA-N 1 1 342.439 4.235 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](c2nccs2)C1 ZINC000470183511 1044977737 /nfs/dbraw/zinc/97/77/37/1044977737.db2.gz CNUOGBXMVGNVBD-DNXIFWLFSA-N 1 1 343.452 4.334 20 5 EIBDMO CCC[C@H](NC[C@H]1CCC[N@@H+](C(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000125868786 1045063902 /nfs/dbraw/zinc/06/39/02/1045063902.db2.gz JAKAEPBKCGJXHA-APWZRJJASA-N 1 1 333.476 4.146 20 5 EIBDMO CCC[C@H](NC[C@H]1CCC[N@H+](C(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000125868786 1045063919 /nfs/dbraw/zinc/06/39/19/1045063919.db2.gz JAKAEPBKCGJXHA-APWZRJJASA-N 1 1 333.476 4.146 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1ccsc1Br ZINC000509440340 1045170725 /nfs/dbraw/zinc/17/07/25/1045170725.db2.gz RYCWAESMYBMGTI-UHFFFAOYSA-N 1 1 341.230 4.017 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCOc1ccc(Cl)cc1 ZINC000302737049 1045194933 /nfs/dbraw/zinc/19/49/33/1045194933.db2.gz FUBGWQSATDDTAI-ZDUSSCGKSA-N 1 1 334.803 4.320 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H](c4ccco4)C3)o2)cc1 ZINC000611271268 1045271869 /nfs/dbraw/zinc/27/18/69/1045271869.db2.gz GBQKKWVBQJCFAW-HNNXBMFYSA-N 1 1 338.363 4.437 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@@H](c4ccco4)C3)o2)c1 ZINC000611271316 1045272264 /nfs/dbraw/zinc/27/22/64/1045272264.db2.gz PNPYNGGAGISSHQ-OAHLLOKOSA-N 1 1 338.363 4.437 20 5 EIBDMO Cc1nn(C)cc1[C@H]1CCC[N@H+]1Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000611285878 1045273135 /nfs/dbraw/zinc/27/31/35/1045273135.db2.gz HHRYWBHWFSQLSW-GOSISDBHSA-N 1 1 342.443 4.097 20 5 EIBDMO Cc1nn(C)cc1[C@H]1CCC[N@@H+]1Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000611285878 1045273144 /nfs/dbraw/zinc/27/31/44/1045273144.db2.gz HHRYWBHWFSQLSW-GOSISDBHSA-N 1 1 342.443 4.097 20 5 EIBDMO Cc1c([C@H](C)[NH2+][C@H]2COc3c2cccc3Cl)cccc1[N+](=O)[O-] ZINC000611336861 1045283273 /nfs/dbraw/zinc/28/32/73/1045283273.db2.gz ZZDWSQWWDYJUBB-NHYWBVRUSA-N 1 1 332.787 4.341 20 5 EIBDMO CC(C)([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccc(F)c(F)c1 ZINC000611402024 1045301093 /nfs/dbraw/zinc/30/10/93/1045301093.db2.gz FOKBUKUMMLNYNJ-UHFFFAOYSA-N 1 1 347.321 4.039 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc(CSC(F)F)o1)c1cccc([N+](=O)[O-])c1 ZINC000193901823 1045541207 /nfs/dbraw/zinc/54/12/07/1045541207.db2.gz IZFYJTFFEFLLOK-SNVBAGLBSA-N 1 1 342.367 4.494 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCSc2c(F)cccc21 ZINC000194154994 1045647092 /nfs/dbraw/zinc/64/70/92/1045647092.db2.gz CRZNHXHWKURZJM-OAHLLOKOSA-N 1 1 348.399 4.069 20 5 EIBDMO COc1ccc(C[N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)cc1C ZINC000768541727 1045817586 /nfs/dbraw/zinc/81/75/86/1045817586.db2.gz KZCRGERIMJYAMW-UHFFFAOYSA-N 1 1 334.803 4.197 20 5 EIBDMO COc1ccc([C@H]2CC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)cc1 ZINC000768541513 1045818532 /nfs/dbraw/zinc/81/85/32/1045818532.db2.gz IGJJYZXNAMYPLC-HNNXBMFYSA-N 1 1 346.814 4.246 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC(c3cccnc3)CC2)c1 ZINC000768752093 1045836636 /nfs/dbraw/zinc/83/66/36/1045836636.db2.gz DFHHNMODKAMGOX-UHFFFAOYSA-N 1 1 331.803 4.023 20 5 EIBDMO OC[C@H]1CC[N@@H+](Cc2c3ccccc3c(Cl)c3ccccc32)C1 ZINC000769238568 1045898867 /nfs/dbraw/zinc/89/88/67/1045898867.db2.gz DIQUMRQDQBNXKE-AWEZNQCLSA-N 1 1 325.839 4.461 20 5 EIBDMO Cc1ccc([C@H](C)[N@H+](C)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000792861255 1046077883 /nfs/dbraw/zinc/07/78/83/1046077883.db2.gz ACZFAUXOEWEMLF-ZDUSSCGKSA-N 1 1 329.356 4.004 20 5 EIBDMO Cc1ccc([C@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000792861255 1046077893 /nfs/dbraw/zinc/07/78/93/1046077893.db2.gz ACZFAUXOEWEMLF-ZDUSSCGKSA-N 1 1 329.356 4.004 20 5 EIBDMO C[C@@H]1OCC[C@]12C[N@@H+](Cc1c3ccccc3cc3ccccc31)CCO2 ZINC000793230983 1046177594 /nfs/dbraw/zinc/17/75/94/1046177594.db2.gz JADHVZCSERKNQR-SBUREZEXSA-N 1 1 347.458 4.373 20 5 EIBDMO O=[N+]([O-])c1cccc(Br)c1C[N@H+](CC1CC1)C1CCC1 ZINC000793393078 1046235960 /nfs/dbraw/zinc/23/59/60/1046235960.db2.gz BLYGQGOUGOHSPJ-UHFFFAOYSA-N 1 1 339.233 4.122 20 5 EIBDMO O=[N+]([O-])c1cccc(Br)c1C[N@@H+](CC1CC1)C1CCC1 ZINC000793393078 1046235975 /nfs/dbraw/zinc/23/59/75/1046235975.db2.gz BLYGQGOUGOHSPJ-UHFFFAOYSA-N 1 1 339.233 4.122 20 5 EIBDMO C[C@H](CCO)[N@@H+](Cc1ccccc1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000772391112 1046631005 /nfs/dbraw/zinc/63/10/05/1046631005.db2.gz VQEFJGKSHWDVLR-CQSZACIVSA-N 1 1 348.830 4.021 20 5 EIBDMO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000459649696 1046834860 /nfs/dbraw/zinc/83/48/60/1046834860.db2.gz LCDWYZXRXBDRPN-GFCCVEGCSA-N 1 1 334.803 4.416 20 5 EIBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000787416910 1047003984 /nfs/dbraw/zinc/00/39/84/1047003984.db2.gz LPGFOOHVDXWQNU-LBPRGKRZSA-N 1 1 336.741 4.411 20 5 EIBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000787416910 1047004000 /nfs/dbraw/zinc/00/40/00/1047004000.db2.gz LPGFOOHVDXWQNU-LBPRGKRZSA-N 1 1 336.741 4.411 20 5 EIBDMO Cc1cccc([C@@H]2CCC[N@H+]2Cn2ncc3ccc([N+](=O)[O-])cc32)c1 ZINC000917617532 1047027067 /nfs/dbraw/zinc/02/70/67/1047027067.db2.gz JVZZIYXFNANIAW-SFHVURJKSA-N 1 1 336.395 4.048 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2CCc3nc(Cl)ccc32)c1 ZINC000806146866 1047171175 /nfs/dbraw/zinc/17/11/75/1047171175.db2.gz DMHHWIBYBAECFW-ZDUSSCGKSA-N 1 1 338.194 4.074 20 5 EIBDMO CCOc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000089512327 1047780714 /nfs/dbraw/zinc/78/07/14/1047780714.db2.gz IRUMGMUZSACBFA-LBPRGKRZSA-N 1 1 334.803 4.498 20 5 EIBDMO C[C@@H]1C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c2ccccc2O1 ZINC000824651073 1047894537 /nfs/dbraw/zinc/89/45/37/1047894537.db2.gz UVKYCNXTHFAJOZ-BDJLRTHQSA-N 1 1 332.787 4.250 20 5 EIBDMO COC[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000825321299 1048069130 /nfs/dbraw/zinc/06/91/30/1048069130.db2.gz BYTSZGAEQSKYPI-LLVKDONJSA-N 1 1 347.242 4.150 20 5 EIBDMO COC[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000825321299 1048069147 /nfs/dbraw/zinc/06/91/47/1048069147.db2.gz BYTSZGAEQSKYPI-LLVKDONJSA-N 1 1 347.242 4.150 20 5 EIBDMO COCC1(C)CC[NH+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000809970208 1048575742 /nfs/dbraw/zinc/57/57/42/1048575742.db2.gz QJGIJIYWXLRHFJ-UHFFFAOYSA-N 1 1 347.242 4.150 20 5 EIBDMO C[N@@H+](CCC1CCOCC1)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809952958 1048580573 /nfs/dbraw/zinc/58/05/73/1048580573.db2.gz DDOGYQYIIKURGL-UHFFFAOYSA-N 1 1 347.242 4.150 20 5 EIBDMO CSC[C@H]1CCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809955239 1048582484 /nfs/dbraw/zinc/58/24/84/1048582484.db2.gz UAZUTYFPFKAKFK-LLVKDONJSA-N 1 1 335.256 4.229 20 5 EIBDMO CSC[C@H]1CCC[N@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809955239 1048582501 /nfs/dbraw/zinc/58/25/01/1048582501.db2.gz UAZUTYFPFKAKFK-LLVKDONJSA-N 1 1 335.256 4.229 20 5 EIBDMO CSc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)s1 ZINC000810147676 1048655101 /nfs/dbraw/zinc/65/51/01/1048655101.db2.gz KAVAYDXHSDHYAA-UHFFFAOYSA-N 1 1 328.846 4.321 20 5 EIBDMO C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNc1ncc([N+](=O)[O-])s1 ZINC000195509031 1048886416 /nfs/dbraw/zinc/88/64/16/1048886416.db2.gz BDDWWICCEJHQEW-CYBMUJFWSA-N 1 1 346.456 4.038 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+](Cc1ccc(F)cc1)CC1CC1 ZINC000609673006 1049261381 /nfs/dbraw/zinc/26/13/81/1049261381.db2.gz CMWAXLPLDRQAKC-UHFFFAOYSA-N 1 1 332.350 4.285 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+](Cc1ccc(F)cc1)CC1CC1 ZINC000609673006 1049261392 /nfs/dbraw/zinc/26/13/92/1049261392.db2.gz CMWAXLPLDRQAKC-UHFFFAOYSA-N 1 1 332.350 4.285 20 5 EIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+](Cc1ccc(F)cc1)CC1CC1 ZINC000609673053 1049262236 /nfs/dbraw/zinc/26/22/36/1049262236.db2.gz LFYOWEFWAMUBGW-UHFFFAOYSA-N 1 1 344.386 4.025 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCS[C@H](c2ccccc2)C1 ZINC000609800733 1049328751 /nfs/dbraw/zinc/32/87/51/1049328751.db2.gz RFBZKFAYRVANDB-KSSFIOAISA-N 1 1 328.437 4.446 20 5 EIBDMO O=[N+]([O-])c1sccc1NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000064550829 1049338256 /nfs/dbraw/zinc/33/82/56/1049338256.db2.gz WESMGYFWNXUXGZ-LBPRGKRZSA-N 1 1 337.470 4.042 20 5 EIBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCCCC[C@H]2c2ccco2)cc1 ZINC000609916244 1049395446 /nfs/dbraw/zinc/39/54/46/1049395446.db2.gz PPVUCMMKYSRJKB-KRWDZBQOSA-N 1 1 330.384 4.184 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCCC4(CCC4)C3)co2)cc1 ZINC000348177768 1049474213 /nfs/dbraw/zinc/47/42/13/1049474213.db2.gz HNVOEJFKRUZFMG-UHFFFAOYSA-N 1 1 327.384 4.016 20 5 EIBDMO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000610091398 1049535196 /nfs/dbraw/zinc/53/51/96/1049535196.db2.gz QJKSUWDVIURUTR-BBRMVZONSA-N 1 1 344.415 4.045 20 5 EIBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccc(Cl)nc1 ZINC000773038592 1049547103 /nfs/dbraw/zinc/54/71/03/1049547103.db2.gz AABAKAROGJIMFC-SECBINFHSA-N 1 1 326.183 4.147 20 5 EIBDMO CCc1cc(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)on1 ZINC000610162254 1049558382 /nfs/dbraw/zinc/55/83/82/1049558382.db2.gz LRZRIPTWRQEQGK-UHFFFAOYSA-N 1 1 343.408 4.164 20 5 EIBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)[C@H](C)[C@H](O)c1ccccc1 ZINC000812850816 1049611961 /nfs/dbraw/zinc/61/19/61/1049611961.db2.gz VTCZMWPHNPFREY-ACJLOTCBSA-N 1 1 348.830 4.192 20 5 EIBDMO C[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccc(OC(F)F)cc1 ZINC000179604212 1049694597 /nfs/dbraw/zinc/69/45/97/1049694597.db2.gz KSEVEGICSDTFAW-SNVBAGLBSA-N 1 1 340.301 4.186 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](COCc2ccccc2)C1 ZINC000247341028 1050021556 /nfs/dbraw/zinc/02/15/56/1050021556.db2.gz GCAUREKPPQTOEH-SJLPKXTDSA-N 1 1 340.423 4.195 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC=C(c2ccc(Cl)nc2)CC1 ZINC000773654243 1050200771 /nfs/dbraw/zinc/20/07/71/1050200771.db2.gz DCMCQBSPENWALG-CYBMUJFWSA-N 1 1 343.814 4.494 20 5 EIBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)Cc2cccc(C)c2)c1F ZINC001173181634 1050337305 /nfs/dbraw/zinc/33/73/05/1050337305.db2.gz CQJPPZCDDUXDPJ-AWEZNQCLSA-N 1 1 346.402 4.114 20 5 EIBDMO COc1ccc([C@H]2CCC[N@H+]2[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173225488 1050356442 /nfs/dbraw/zinc/35/64/42/1050356442.db2.gz CMGVGEQBMYWUDM-MGPUTAFESA-N 1 1 340.423 4.372 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC001173231777 1050358940 /nfs/dbraw/zinc/35/89/40/1050358940.db2.gz CZQSFLRGAXKIFT-YOEHRIQHSA-N 1 1 328.387 4.154 20 5 EIBDMO CC[N@@H+](Cc1cccc(OC)c1)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173234603 1050361650 /nfs/dbraw/zinc/36/16/50/1050361650.db2.gz SKLGOMUZDQHRQT-HNNXBMFYSA-N 1 1 328.412 4.057 20 5 EIBDMO COc1ccccc1[C@@H](C)[N@@H+](C)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173234205 1050362566 /nfs/dbraw/zinc/36/25/66/1050362566.db2.gz PVJXTSDXYMNHDI-LSDHHAIUSA-N 1 1 328.412 4.227 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C(C)(C)Cc1ccccc1 ZINC001173233821 1050363658 /nfs/dbraw/zinc/36/36/58/1050363658.db2.gz ZFJIDAUKLNTIOH-MRXNPFEDSA-N 1 1 326.440 4.479 20 5 EIBDMO C[C@@H]1CN(c2ccccc2[N+](=O)[O-])[C@H](C)[C@@H](C)[N@H+]1Cc1ccccc1 ZINC001186906715 1050446509 /nfs/dbraw/zinc/44/65/09/1050446509.db2.gz VTAFWAZYUPOADS-BRWVUGGUSA-N 1 1 339.439 4.083 20 5 EIBDMO CC(C)(C)n1c[nH+]cc1[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2F)C1 ZINC001187903017 1050639042 /nfs/dbraw/zinc/63/90/42/1050639042.db2.gz BQVZIWTXJSUFST-CYBMUJFWSA-N 1 1 346.406 4.069 20 5 EIBDMO CCOC[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000093838730 1050705174 /nfs/dbraw/zinc/70/51/74/1050705174.db2.gz IOQULNBTWCDFTJ-CQSZACIVSA-N 1 1 346.452 4.182 20 5 EIBDMO Cc1cccnc1[C@H](C)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC001179784300 1050777242 /nfs/dbraw/zinc/77/72/42/1050777242.db2.gz GRPMQFYIKBFLLA-AWEZNQCLSA-N 1 1 337.379 4.409 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cccc3cnccc32)C2CC2)c1 ZINC000183062826 1050951008 /nfs/dbraw/zinc/95/10/08/1050951008.db2.gz JMWBYDGNBKLMOF-UHFFFAOYSA-N 1 1 333.391 4.308 20 5 EIBDMO C[C@H]1CN(C)c2ccccc2C[N@@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC001174623546 1051088001 /nfs/dbraw/zinc/08/80/01/1051088001.db2.gz SAXLPRQNNVOGRW-ZDUSSCGKSA-N 1 1 345.830 4.089 20 5 EIBDMO C[C@H]1CN(C)c2ccccc2C[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC001174623546 1051088012 /nfs/dbraw/zinc/08/80/12/1051088012.db2.gz SAXLPRQNNVOGRW-ZDUSSCGKSA-N 1 1 345.830 4.089 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](Oc2ccccc2)C1 ZINC001174742485 1051160896 /nfs/dbraw/zinc/16/08/96/1051160896.db2.gz MOWJOZBKUMIJGY-CRAIPNDOSA-N 1 1 326.396 4.118 20 5 EIBDMO CC(C)C1CC[NH+](Cc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC001191013323 1051325825 /nfs/dbraw/zinc/32/58/25/1051325825.db2.gz JNNUPEODDDTEFV-UHFFFAOYSA-N 1 1 341.249 4.225 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@H](C)c1nccs1 ZINC000183928571 1051653222 /nfs/dbraw/zinc/65/32/22/1051653222.db2.gz WXPIJJFOIGYTBC-ZDUSSCGKSA-N 1 1 349.456 4.074 20 5 EIBDMO Cc1ccc([C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)c(C)c1 ZINC001194074597 1052070695 /nfs/dbraw/zinc/07/06/95/1052070695.db2.gz YBPAJLKYLXTIKO-MRXNPFEDSA-N 1 1 328.387 4.340 20 5 EIBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCC[C@H]1/C=C/c1ccccc1 ZINC001176639478 1052148909 /nfs/dbraw/zinc/14/89/09/1052148909.db2.gz HNNBBVRHPREXJO-MZEUMTGBSA-N 1 1 326.371 4.412 20 5 EIBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@H]1/C=C/c1ccccc1 ZINC001176639478 1052148917 /nfs/dbraw/zinc/14/89/17/1052148917.db2.gz HNNBBVRHPREXJO-MZEUMTGBSA-N 1 1 326.371 4.412 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](CC2CC2)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000774877495 1052237208 /nfs/dbraw/zinc/23/72/08/1052237208.db2.gz YSODLFDNKXBXPI-UHFFFAOYSA-N 1 1 333.388 4.048 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(C(=O)c2ccccc2)CC1 ZINC000075595882 1052354045 /nfs/dbraw/zinc/35/40/45/1052354045.db2.gz VCCWFLAKJCOTQI-HNNXBMFYSA-N 1 1 338.407 4.251 20 5 EIBDMO Cc1ccc([C@H]2CCC[N@@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)s1 ZINC000083174206 1052844281 /nfs/dbraw/zinc/84/42/81/1052844281.db2.gz UKTXBIYKTWZWCS-CQSZACIVSA-N 1 1 343.408 4.443 20 5 EIBDMO Cc1ccc([C@H]2CCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)s1 ZINC000083174206 1052844288 /nfs/dbraw/zinc/84/42/88/1052844288.db2.gz UKTXBIYKTWZWCS-CQSZACIVSA-N 1 1 343.408 4.443 20 5 EIBDMO CC(C)(C)C[C@H]1CC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1(C)C ZINC001195064296 1053252556 /nfs/dbraw/zinc/25/25/56/1053252556.db2.gz CMUVBTWMVNPZKG-CQSZACIVSA-N 1 1 347.459 4.070 20 5 EIBDMO CC[C@H](C)C[N@@H+](CC)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159434360 1053342021 /nfs/dbraw/zinc/34/20/21/1053342021.db2.gz DHBABMQPLPYEIP-NSHDSACASA-N 1 1 329.238 4.225 20 5 EIBDMO Cc1ccc([C@@H]2CCCC[N@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776585316 1053561359 /nfs/dbraw/zinc/56/13/59/1053561359.db2.gz VFXFPIHOYBUHLF-PMACEKPBSA-N 1 1 340.423 4.164 20 5 EIBDMO Cc1cc(Nc2cccc([C@H](C)[NH+]3CCOCC3)c2)ccc1[N+](=O)[O-] ZINC000552387907 1053894046 /nfs/dbraw/zinc/89/40/46/1053894046.db2.gz FKZCBULNXAFRPQ-HNNXBMFYSA-N 1 1 341.411 4.040 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1/C=C/c1ccccc1 ZINC001198271600 1054120564 /nfs/dbraw/zinc/12/05/64/1054120564.db2.gz XFYSQXINYZDZFB-BBVFFXRHSA-N 1 1 338.407 4.281 20 5 EIBDMO C[C@H]([NH2+][C@@H]1CSCc2ccccc21)c1c(F)cccc1[N+](=O)[O-] ZINC000872029531 1054348040 /nfs/dbraw/zinc/34/80/40/1054348040.db2.gz RGFNEPJJAKBNQN-XHDPSFHLSA-N 1 1 332.400 4.373 20 5 EIBDMO COc1ccc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1Cl ZINC000872047980 1054362906 /nfs/dbraw/zinc/36/29/06/1054362906.db2.gz FQAIVAGWLGYUDA-JTQLQIEISA-N 1 1 338.766 4.247 20 5 EIBDMO COc1ccc(C)[nH+]c1NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001201273182 1054740273 /nfs/dbraw/zinc/74/02/73/1054740273.db2.gz JLDJWUXUMXUMEY-UHFFFAOYSA-N 1 1 339.351 4.179 20 5 EIBDMO CCn1c2ccccc2nc1[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000173428807 1054950828 /nfs/dbraw/zinc/95/08/28/1054950828.db2.gz QBXDHHIYXXSDRC-KGLIPLIRSA-N 1 1 338.411 4.376 20 5 EIBDMO Cc1cc([NH+](C)C)cc(C)c1NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000877350251 1055044716 /nfs/dbraw/zinc/04/47/16/1055044716.db2.gz JASVZDAVSFNEBY-UHFFFAOYSA-N 1 1 340.383 4.031 20 5 EIBDMO COc1ccc(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])cc1Cl ZINC000776251720 1055057946 /nfs/dbraw/zinc/05/79/46/1055057946.db2.gz WHZRFFBBHQNUGU-UHFFFAOYSA-N 1 1 341.194 4.200 20 5 EIBDMO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776280467 1055154923 /nfs/dbraw/zinc/15/49/23/1055154923.db2.gz ZXWCSKWPLMDGPT-SUMWQHHRSA-N 1 1 340.379 4.067 20 5 EIBDMO Cc1ccc2sc(C[NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3)nc2c1 ZINC001168604615 1055207277 /nfs/dbraw/zinc/20/72/77/1055207277.db2.gz QASWEJVANBJTKI-LBPRGKRZSA-N 1 1 327.409 4.364 20 5 EIBDMO CCOc1ccc([C@H](C)[NH2+][C@H](C)c2nc(C)cs2)cc1[N+](=O)[O-] ZINC000153546329 1055517501 /nfs/dbraw/zinc/51/75/01/1055517501.db2.gz BKOBBROKABXRMO-NWDGAFQWSA-N 1 1 335.429 4.170 20 5 EIBDMO C[C@@H]1C[C@@H](Nc2cccc(F)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000301508518 1055647332 /nfs/dbraw/zinc/64/73/32/1055647332.db2.gz AQBPSVXDGNISDJ-ZBFHGGJFSA-N 1 1 343.402 4.199 20 5 EIBDMO C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000301561588 1055731543 /nfs/dbraw/zinc/73/15/43/1055731543.db2.gz UXKWDNSFYFRHCI-QAPCUYQASA-N 1 1 325.412 4.060 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC[C@H]1c1ccccc1 ZINC000741807682 1058377399 /nfs/dbraw/zinc/37/73/99/1058377399.db2.gz JZUGMDZKUYONBQ-RDTXWAMCSA-N 1 1 328.387 4.360 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCC4(C3)CCCCC4)c2)cc1 ZINC000742165354 1058525171 /nfs/dbraw/zinc/52/51/71/1058525171.db2.gz HXJKCMQMUVXUEP-UHFFFAOYSA-N 1 1 340.427 4.072 20 5 EIBDMO COc1cccc2cc(C[NH2+][C@@H](C)c3ccccc3[N+](=O)[O-])oc21 ZINC000743475487 1059024534 /nfs/dbraw/zinc/02/45/34/1059024534.db2.gz UJWYOTUWBLIZNJ-LBPRGKRZSA-N 1 1 326.352 4.200 20 5 EIBDMO CCc1ccc(N2CC[NH+]([C@H](C)c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000743868328 1059179974 /nfs/dbraw/zinc/17/99/74/1059179974.db2.gz UFUNPDGXQXVRPL-MRXNPFEDSA-N 1 1 339.439 4.040 20 5 EIBDMO C[N@@H+](Cc1cccc(Oc2ccccc2)c1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169046669 1060603806 /nfs/dbraw/zinc/60/38/06/1060603806.db2.gz LRWFHQHMNOXXCH-MSOLQXFVSA-N 1 1 340.423 4.356 20 5 EIBDMO CC[C@@H](c1ccncc1)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000130214042 1032345196 /nfs/dbraw/zinc/34/51/96/1032345196.db2.gz VWEMZXGRXOVDRC-SFHVURJKSA-N 1 1 343.427 4.360 20 5 EIBDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000130214042 1032345211 /nfs/dbraw/zinc/34/52/11/1032345211.db2.gz VWEMZXGRXOVDRC-SFHVURJKSA-N 1 1 343.427 4.360 20 5 EIBDMO CC[C@H](c1ccncc1)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000130214250 1032349219 /nfs/dbraw/zinc/34/92/19/1032349219.db2.gz VWEMZXGRXOVDRC-GOSISDBHSA-N 1 1 343.427 4.360 20 5 EIBDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000130214250 1032349228 /nfs/dbraw/zinc/34/92/28/1032349228.db2.gz VWEMZXGRXOVDRC-GOSISDBHSA-N 1 1 343.427 4.360 20 5 EIBDMO COc1ccsc1[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000274625847 1018846951 /nfs/dbraw/zinc/84/69/51/1018846951.db2.gz XYMUSSWEBCMCRA-SECBINFHSA-N 1 1 326.805 4.169 20 5 EIBDMO COCC(C)(C)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000430146169 1018862852 /nfs/dbraw/zinc/86/28/52/1018862852.db2.gz GKMKUHSUQHFIEU-UHFFFAOYSA-N 1 1 334.441 4.180 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@@H](C)c1cccc(OC)c1 ZINC000430202416 1019261804 /nfs/dbraw/zinc/26/18/04/1019261804.db2.gz COZUQOWUCCLBOZ-AWEZNQCLSA-N 1 1 344.411 4.195 20 5 EIBDMO C[C@H]1CCCC[N@H+]1CCC1CCN(c2sccc2[N+](=O)[O-])CC1 ZINC000302021719 1019407741 /nfs/dbraw/zinc/40/77/41/1019407741.db2.gz OFLOMVQISDSRPJ-AWEZNQCLSA-N 1 1 337.489 4.137 20 5 EIBDMO CC[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCCC[C@@H]1C ZINC000120058477 1019972259 /nfs/dbraw/zinc/97/22/59/1019972259.db2.gz RYZGCZHFJPZFCR-XJKSGUPXSA-N 1 1 344.415 4.045 20 5 EIBDMO CCc1ccc([C@H](COC)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000165247000 1019994990 /nfs/dbraw/zinc/99/49/90/1019994990.db2.gz QARKOLCXTIYEEJ-BBRMVZONSA-N 1 1 332.400 4.097 20 5 EIBDMO CCS[C@@H]1CCCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000609705132 1020031133 /nfs/dbraw/zinc/03/11/33/1020031133.db2.gz SCWFOWPLZAHRGY-CQSZACIVSA-N 1 1 328.865 4.356 20 5 EIBDMO Cc1ccc([C@@H](C)[N@@H+](C)CCOc2ccccc2[N+](=O)[O-])c(C)c1 ZINC001167145846 1020364722 /nfs/dbraw/zinc/36/47/22/1020364722.db2.gz IKJHLJDQCRUQRB-MRXNPFEDSA-N 1 1 328.412 4.283 20 5 EIBDMO C[N@H+]1CCC[C@@H](CNc2ccsc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000610281326 1020965624 /nfs/dbraw/zinc/96/56/24/1020965624.db2.gz MWHWVYQXOJYLIN-FZMZJTMJSA-N 1 1 337.470 4.213 20 5 EIBDMO COc1ccc(C[N@H+]2C[C@H](c3ccccc3C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000610001847 1021082749 /nfs/dbraw/zinc/08/27/49/1021082749.db2.gz FSVAOAYWJIJSCN-NVXWUHKLSA-N 1 1 340.423 4.290 20 5 EIBDMO COc1cccc(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)c1 ZINC000180004880 1021305388 /nfs/dbraw/zinc/30/53/88/1021305388.db2.gz APWMVVPBJCVSOT-OAQYLSRUSA-N 1 1 348.402 4.483 20 5 EIBDMO C[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1nc2ccccc2n1C(F)F ZINC000548074423 1021836286 /nfs/dbraw/zinc/83/62/86/1021836286.db2.gz YQMUJULPNYXUNK-NSHDSACASA-N 1 1 346.337 4.190 20 5 EIBDMO Cc1c([C@H](C)[NH2+][C@@H](C)c2nc3c(s2)CCC3)cccc1[N+](=O)[O-] ZINC000414133601 1021913820 /nfs/dbraw/zinc/91/38/20/1021913820.db2.gz AOQUNCBULIWIOB-RYUDHWBXSA-N 1 1 331.441 4.260 20 5 EIBDMO O=[N+]([O-])c1c(F)cccc1NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000311072353 1022862079 /nfs/dbraw/zinc/86/20/79/1022862079.db2.gz ZHNJFJXSRKYTGX-MRXNPFEDSA-N 1 1 343.402 4.058 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@]4(CC=CCC4)C3)nc2c1 ZINC000177076152 1022871040 /nfs/dbraw/zinc/87/10/40/1022871040.db2.gz GLAJJZRAOPIXGE-SFHVURJKSA-N 1 1 327.384 4.058 20 5 EIBDMO Cc1ccoc1C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549717629 1033100269 /nfs/dbraw/zinc/10/02/69/1033100269.db2.gz HOXUQKCQRKBAJH-UHFFFAOYSA-N 1 1 328.290 4.147 20 5 EIBDMO Cc1ccoc1C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549717629 1033100256 /nfs/dbraw/zinc/10/02/56/1033100256.db2.gz HOXUQKCQRKBAJH-UHFFFAOYSA-N 1 1 328.290 4.147 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC[C@@H]4CCC[C@@H]43)o2)c1 ZINC000072693719 1023026118 /nfs/dbraw/zinc/02/61/18/1023026118.db2.gz OVWDZDQDARQAOM-YOEHRIQHSA-N 1 1 341.411 4.057 20 5 EIBDMO Cc1ccccc1C[N@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000023841499 1023187096 /nfs/dbraw/zinc/18/70/96/1023187096.db2.gz YTRBEIUAXNZIPM-UHFFFAOYSA-N 1 1 343.408 4.270 20 5 EIBDMO Cc1ccccc1C[N@@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000023841499 1023187108 /nfs/dbraw/zinc/18/71/08/1023187108.db2.gz YTRBEIUAXNZIPM-UHFFFAOYSA-N 1 1 343.408 4.270 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CC[C@@H](COc2ccccc2)C1 ZINC000780371259 1023457764 /nfs/dbraw/zinc/45/77/64/1023457764.db2.gz QSKGICOHOAWTGO-CQSZACIVSA-N 1 1 346.814 4.149 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CC[C@@H](COc2ccccc2)C1 ZINC000780371259 1023457772 /nfs/dbraw/zinc/45/77/72/1023457772.db2.gz QSKGICOHOAWTGO-CQSZACIVSA-N 1 1 346.814 4.149 20 5 EIBDMO COc1ccc(C[NH2+]Cc2cc(Cl)sc2Cl)cc1[N+](=O)[O-] ZINC000312879217 1023870333 /nfs/dbraw/zinc/87/03/33/1023870333.db2.gz OHEUWIZTHNWSKM-UHFFFAOYSA-N 1 1 347.223 4.262 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cc2ccccc2o1 ZINC000181763946 1024065238 /nfs/dbraw/zinc/06/52/38/1024065238.db2.gz NNPNJRABKITHQW-LBPRGKRZSA-N 1 1 326.352 4.200 20 5 EIBDMO C[C@@H](c1ccco1)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549796582 1033201345 /nfs/dbraw/zinc/20/13/45/1033201345.db2.gz COQMTEAYDYMGOZ-JTQLQIEISA-N 1 1 328.290 4.400 20 5 EIBDMO C[C@@H](c1ccco1)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549796582 1033201359 /nfs/dbraw/zinc/20/13/59/1033201359.db2.gz COQMTEAYDYMGOZ-JTQLQIEISA-N 1 1 328.290 4.400 20 5 EIBDMO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]Cc1cc(-c2ccccc2)on1 ZINC000549806286 1033231579 /nfs/dbraw/zinc/23/15/79/1033231579.db2.gz OZBZUDYKQBDBNF-POHAHGRESA-N 1 1 335.363 4.053 20 5 EIBDMO C[C@H]1CCCC[N@H+]1CCC1CCN(c2ccc([N+](=O)[O-])s2)CC1 ZINC000610786820 1024851340 /nfs/dbraw/zinc/85/13/40/1024851340.db2.gz IUVWAZKJFMKGPL-AWEZNQCLSA-N 1 1 337.489 4.137 20 5 EIBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c(F)c1 ZINC000065202094 1025150875 /nfs/dbraw/zinc/15/08/75/1025150875.db2.gz DXRGNDFJKXKHGG-INIZCTEOSA-N 1 1 343.402 4.058 20 5 EIBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1cccc(-c3ccccn3)c1)C2 ZINC000538725731 1025511016 /nfs/dbraw/zinc/51/10/16/1025511016.db2.gz SJZHCOLAJFCMKE-UHFFFAOYSA-N 1 1 345.402 4.215 20 5 EIBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1cccc(-c3ccccn3)c1)C2 ZINC000538725731 1025511044 /nfs/dbraw/zinc/51/10/44/1025511044.db2.gz SJZHCOLAJFCMKE-UHFFFAOYSA-N 1 1 345.402 4.215 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N(C)C ZINC000472080531 1025697842 /nfs/dbraw/zinc/69/78/42/1025697842.db2.gz PZRVMSODWXCACF-ACJLOTCBSA-N 1 1 347.846 4.029 20 5 EIBDMO CC[N@@H+](C[C@H](O)c1ccc(C)cc1)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC001167517882 1025898875 /nfs/dbraw/zinc/89/88/75/1025898875.db2.gz SKVSTZQXNXJRSJ-JXFKEZNVSA-N 1 1 342.439 4.328 20 5 EIBDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2cccc([N+](=O)[O-])c2)C12CCCCC2 ZINC001167535355 1025980313 /nfs/dbraw/zinc/98/03/13/1025980313.db2.gz VGHVNPDQFUZIKA-ZWKOTPCHSA-N 1 1 332.444 4.155 20 5 EIBDMO C[C@@H]([NH2+]Cc1cc(F)c(Cl)cc1F)c1ccc([N+](=O)[O-])cc1 ZINC000432517520 1026277209 /nfs/dbraw/zinc/27/72/09/1026277209.db2.gz GMXGDBHJVAFAGU-SECBINFHSA-N 1 1 326.730 4.377 20 5 EIBDMO CC(C)c1ccc(C[NH2+][C@H](c2ccccc2F)[C@@H](C)O)cc1[N+](=O)[O-] ZINC000582185603 1026320028 /nfs/dbraw/zinc/32/00/28/1026320028.db2.gz RWUBSJVUJHPIJY-YJYMSZOUSA-N 1 1 346.402 4.069 20 5 EIBDMO COc1cc(C[NH2+][C@H](C)c2cccc(Cl)c2)c([N+](=O)[O-])cc1F ZINC000184297925 1026391495 /nfs/dbraw/zinc/39/14/95/1026391495.db2.gz XOPUFWKISSNBFI-SNVBAGLBSA-N 1 1 338.766 4.247 20 5 EIBDMO C[C@@H]([NH2+][C@H](CN1CCCC1)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000178642351 1026976995 /nfs/dbraw/zinc/97/69/95/1026976995.db2.gz FBVWDCRFHBAJAG-OXQOHEQNSA-N 1 1 339.439 4.083 20 5 EIBDMO C[C@@H](NCc1cccc(C[NH+]2CCCC2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000178643357 1027059372 /nfs/dbraw/zinc/05/93/72/1027059372.db2.gz MVSNGCRUCWMCPG-MRXNPFEDSA-N 1 1 339.439 4.041 20 5 EIBDMO COc1ccc(C[N@H+]2C[C@@H](C)C[C@@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000441353285 1027472617 /nfs/dbraw/zinc/47/26/17/1027472617.db2.gz YZIQWHZVAXRTHY-SUMWQHHRSA-N 1 1 344.386 4.326 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000441401218 1027523532 /nfs/dbraw/zinc/52/35/32/1027523532.db2.gz XUZQZULIUKAJAR-KZNAEPCWSA-N 1 1 345.487 4.242 20 5 EIBDMO COC(=O)c1cc([C@H](C)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)oc1C ZINC000292389258 1027663649 /nfs/dbraw/zinc/66/36/49/1027663649.db2.gz HZLDWKQKZQIZAR-RYUDHWBXSA-N 1 1 346.383 4.003 20 5 EIBDMO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1cc(F)ccc1F ZINC000178728963 1027773154 /nfs/dbraw/zinc/77/31/54/1027773154.db2.gz NRJACIPMYVVDPC-MRXNPFEDSA-N 1 1 336.338 4.123 20 5 EIBDMO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444601433 1027886537 /nfs/dbraw/zinc/88/65/37/1027886537.db2.gz ZRLBUNOIZKUHLG-SFHVURJKSA-N 1 1 336.395 4.117 20 5 EIBDMO Cc1ccc([C@@H]2CCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444601433 1027886541 /nfs/dbraw/zinc/88/65/41/1027886541.db2.gz ZRLBUNOIZKUHLG-SFHVURJKSA-N 1 1 336.395 4.117 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2ccc(C)c(C)c2)C2CC2)cc1[N+](=O)[O-] ZINC000583173532 1028177615 /nfs/dbraw/zinc/17/76/15/1028177615.db2.gz GINHKKJZRNDPSU-UHFFFAOYSA-N 1 1 340.423 4.385 20 5 EIBDMO CCOc1ccc([C@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000523702015 1028325833 /nfs/dbraw/zinc/32/58/33/1028325833.db2.gz SJYSMCBLILHTCD-HXUWFJFHSA-N 1 1 340.423 4.373 20 5 EIBDMO C[C@H](c1ccc(OC(F)F)cc1)[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536005123 1028612623 /nfs/dbraw/zinc/61/26/23/1028612623.db2.gz YJDFTWFWHBNCQK-GFCCVEGCSA-N 1 1 348.349 4.316 20 5 EIBDMO C[C@H](c1ccc(OC(F)F)cc1)[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536005123 1028612632 /nfs/dbraw/zinc/61/26/32/1028612632.db2.gz YJDFTWFWHBNCQK-GFCCVEGCSA-N 1 1 348.349 4.316 20 5 EIBDMO COc1c(C)c[nH+]c(CN(C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1C ZINC000445583078 1028746536 /nfs/dbraw/zinc/74/65/36/1028746536.db2.gz JZAVBBVMWVNPSU-HNNXBMFYSA-N 1 1 343.427 4.117 20 5 EIBDMO COc1c(C)cnc(C[N@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1C ZINC000445583078 1028746544 /nfs/dbraw/zinc/74/65/44/1028746544.db2.gz JZAVBBVMWVNPSU-HNNXBMFYSA-N 1 1 343.427 4.117 20 5 EIBDMO COc1c(C)cnc(C[N@@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1C ZINC000445583078 1028746561 /nfs/dbraw/zinc/74/65/61/1028746561.db2.gz JZAVBBVMWVNPSU-HNNXBMFYSA-N 1 1 343.427 4.117 20 5 EIBDMO C[C@H]1CCC[N@H+](C(C)(C)CNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000524266223 1028834299 /nfs/dbraw/zinc/83/42/99/1028834299.db2.gz ZUXNPJQPLOKEOG-AWEZNQCLSA-N 1 1 342.443 4.065 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCO[C@@H](c3ccccc3)C2)c(Cl)c1 ZINC000611782064 1029034693 /nfs/dbraw/zinc/03/46/93/1029034693.db2.gz DNHIFAYOPDLQRR-GOSISDBHSA-N 1 1 346.814 4.212 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCO[C@@H](c3ccccc3)C2)c(Cl)c1 ZINC000611782064 1029034715 /nfs/dbraw/zinc/03/47/15/1029034715.db2.gz DNHIFAYOPDLQRR-GOSISDBHSA-N 1 1 346.814 4.212 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1c(F)cc(F)cc1F)CCC2 ZINC000340488720 1029403545 /nfs/dbraw/zinc/40/35/45/1029403545.db2.gz ODUAUKSTLDJLLW-QGZVFWFLSA-N 1 1 336.313 4.179 20 5 EIBDMO CC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H](C)c1cccc(OC)c1 ZINC000052706385 1029426099 /nfs/dbraw/zinc/42/60/99/1029426099.db2.gz XLASHQUMAIRMOZ-AWEZNQCLSA-N 1 1 344.411 4.195 20 5 EIBDMO C[C@@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])CC[C@@H]1c1ccccc1 ZINC000525123362 1029464895 /nfs/dbraw/zinc/46/48/95/1029464895.db2.gz YVGGZWROPQPRDT-AEFFLSMTSA-N 1 1 340.423 4.099 20 5 EIBDMO CC[C@H](O)C[N@H+](Cc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000441067396 1029508978 /nfs/dbraw/zinc/50/89/78/1029508978.db2.gz QNFOHBKFBYBDHQ-KRWDZBQOSA-N 1 1 348.830 4.021 20 5 EIBDMO CC[C@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000441067396 1029508987 /nfs/dbraw/zinc/50/89/87/1029508987.db2.gz QNFOHBKFBYBDHQ-KRWDZBQOSA-N 1 1 348.830 4.021 20 5 EIBDMO C[C@@]1(O)CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000475342883 1029557730 /nfs/dbraw/zinc/55/77/30/1029557730.db2.gz MFXBJURSOVYDGC-GOSISDBHSA-N 1 1 346.452 4.060 20 5 EIBDMO Cc1nc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)sc1C ZINC000451549700 1030568536 /nfs/dbraw/zinc/56/85/36/1030568536.db2.gz QHPOMHLUSXVACP-OAHLLOKOSA-N 1 1 331.441 4.048 20 5 EIBDMO COc1ccc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000052455973 1031004393 /nfs/dbraw/zinc/00/43/93/1031004393.db2.gz VPEMLDHEPBHFPW-INIZCTEOSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000052455973 1031004408 /nfs/dbraw/zinc/00/44/08/1031004408.db2.gz VPEMLDHEPBHFPW-INIZCTEOSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1ccc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000052455971 1031005294 /nfs/dbraw/zinc/00/52/94/1031005294.db2.gz VPEMLDHEPBHFPW-MRXNPFEDSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000052455971 1031005315 /nfs/dbraw/zinc/00/53/15/1031005315.db2.gz VPEMLDHEPBHFPW-MRXNPFEDSA-N 1 1 330.359 4.080 20 5 EIBDMO Cc1ccc2c(C)cc(N3CCc4ccc([N+](=O)[O-])cc4C3)[nH+]c2c1 ZINC000472395137 1031156833 /nfs/dbraw/zinc/15/68/33/1031156833.db2.gz HKYGQVAOEWEMPJ-UHFFFAOYSA-N 1 1 333.391 4.323 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccc(-c2cccc(F)c2F)o1 ZINC000480633007 1031593265 /nfs/dbraw/zinc/59/32/65/1031593265.db2.gz DZLATDDIMLHEKY-UHFFFAOYSA-N 1 1 344.317 4.423 20 5 EIBDMO Cc1nn(C(C)C)cc1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449496044 1031805010 /nfs/dbraw/zinc/80/50/10/1031805010.db2.gz FYEMQBHNBCEGAO-QGZVFWFLSA-N 1 1 342.443 4.060 20 5 EIBDMO C[C@H]([NH2+]Cc1cc(F)c(Cl)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000433088445 1033823963 /nfs/dbraw/zinc/82/39/63/1033823963.db2.gz MHHJUOAWLXMTOU-VIFPVBQESA-N 1 1 326.730 4.377 20 5 EIBDMO CC1(C)C[C@@H]([NH2+]Cc2cc(F)ccc2F)c2cc([N+](=O)[O-])ccc21 ZINC000433168336 1033983555 /nfs/dbraw/zinc/98/35/55/1033983555.db2.gz MKUUBTRPSGETHI-QGZVFWFLSA-N 1 1 332.350 4.385 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cnc(C4CC4)s3)C2)cc1 ZINC000571629371 1034898109 /nfs/dbraw/zinc/89/81/09/1034898109.db2.gz IHQOGKWBEJDEJB-HNNXBMFYSA-N 1 1 343.452 4.308 20 5 EIBDMO CC[C@@H](N[C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000183195510 1035338061 /nfs/dbraw/zinc/33/80/61/1035338061.db2.gz IGYKZUOQMAWHLY-XAUMDUMWSA-N 1 1 345.487 4.289 20 5 EIBDMO CC[C@@H](N[C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000183195510 1035338064 /nfs/dbraw/zinc/33/80/64/1035338064.db2.gz IGYKZUOQMAWHLY-XAUMDUMWSA-N 1 1 345.487 4.289 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccc(C)cc1SC ZINC000595022795 1035510723 /nfs/dbraw/zinc/51/07/23/1035510723.db2.gz WKPAAQIUXCEROK-CYBMUJFWSA-N 1 1 346.452 4.485 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1(c2ccccc2F)CCC1 ZINC000595045717 1035567850 /nfs/dbraw/zinc/56/78/50/1035567850.db2.gz OCJNLEMUNCBTLX-ZDUSSCGKSA-N 1 1 344.386 4.473 20 5 EIBDMO C[C@@H]([NH2+]Cc1cc(F)ccc1OC(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000595094296 1035604304 /nfs/dbraw/zinc/60/43/04/1035604304.db2.gz VMBZNBWXXSICHF-SNVBAGLBSA-N 1 1 340.301 4.186 20 5 EIBDMO CCc1ccc([C@@H]2CCCCC[N@@H+]2Cc2onc(C)c2[N+](=O)[O-])o1 ZINC000595326397 1035629963 /nfs/dbraw/zinc/62/99/63/1035629963.db2.gz BZQCEJLCFKIHBG-AWEZNQCLSA-N 1 1 333.388 4.164 20 5 EIBDMO CCc1ccc([C@@H]2CCCCC[N@H+]2Cc2onc(C)c2[N+](=O)[O-])o1 ZINC000595326397 1035629976 /nfs/dbraw/zinc/62/99/76/1035629976.db2.gz BZQCEJLCFKIHBG-AWEZNQCLSA-N 1 1 333.388 4.164 20 5 EIBDMO C[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1cccc(OC(F)F)c1 ZINC000595417264 1035672631 /nfs/dbraw/zinc/67/26/31/1035672631.db2.gz VKAWSOSMGKNXSS-JTQLQIEISA-N 1 1 340.301 4.186 20 5 EIBDMO Cc1noc(C[N@H+](C)[C@H]2CCCC[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000595548481 1035703979 /nfs/dbraw/zinc/70/39/79/1035703979.db2.gz SNUMZCUFWUORBN-CVEARBPZSA-N 1 1 329.400 4.049 20 5 EIBDMO CCC(CC)CCC[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000595828991 1035800889 /nfs/dbraw/zinc/80/08/89/1035800889.db2.gz FZJRHUPUWPNOPD-UHFFFAOYSA-N 1 1 346.431 4.293 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2nc3c(s2)CCC3)cc1[N+](=O)[O-] ZINC000502016863 1035807777 /nfs/dbraw/zinc/80/77/77/1035807777.db2.gz LGNFSHKLKBJJCG-NWDGAFQWSA-N 1 1 331.441 4.260 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cc3ccncc3s2)C2CC2)cc1 ZINC000596979974 1036063130 /nfs/dbraw/zinc/06/31/30/1036063130.db2.gz QVBGKTQAJMSMJL-UHFFFAOYSA-N 1 1 339.420 4.369 20 5 EIBDMO Cc1ccc([C@@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)C2CC2)cc1 ZINC000602510648 1036486987 /nfs/dbraw/zinc/48/69/87/1036486987.db2.gz LILGZJJSMHUTRU-LJQANCHMSA-N 1 1 337.379 4.285 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[NH2+]Cc3ccc(C4CCC4)cc3)nc2c1 ZINC000602635511 1036548387 /nfs/dbraw/zinc/54/83/87/1036548387.db2.gz RWVKDILRJPJUBV-UHFFFAOYSA-N 1 1 337.379 4.293 20 5 EIBDMO CC[C@@](C)([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccc(F)cc1 ZINC000602729571 1036594502 /nfs/dbraw/zinc/59/45/02/1036594502.db2.gz WILULUHDVXFJMC-GOSISDBHSA-N 1 1 343.358 4.290 20 5 EIBDMO Cc1n[nH]c(C)c1[C@@H]1CCCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000589200106 1036707318 /nfs/dbraw/zinc/70/73/18/1036707318.db2.gz QKTNUSGEBSLHAU-KRWDZBQOSA-N 1 1 346.406 4.191 20 5 EIBDMO Cc1n[nH]c(C)c1[C@@H]1CCCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000589200106 1036707346 /nfs/dbraw/zinc/70/73/46/1036707346.db2.gz QKTNUSGEBSLHAU-KRWDZBQOSA-N 1 1 346.406 4.191 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc3ccc(F)cc3[nH]2)c(Cl)c1 ZINC000486698972 1036819827 /nfs/dbraw/zinc/81/98/27/1036819827.db2.gz JMFGSIFCYOBYLK-UHFFFAOYSA-N 1 1 333.750 4.158 20 5 EIBDMO CC1(C)C[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])c2cc(F)ccc2O1 ZINC000593674389 1036874687 /nfs/dbraw/zinc/87/46/87/1036874687.db2.gz RNDGNMLBINTKBB-HNNXBMFYSA-N 1 1 330.359 4.126 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@]4(CC4(F)F)C3)o2)c1 ZINC000593696509 1036897766 /nfs/dbraw/zinc/89/77/66/1036897766.db2.gz GGBBTVQRXLNXBN-INIZCTEOSA-N 1 1 334.322 4.086 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@@]4(CC4(F)F)C3)o2)c1 ZINC000593696510 1036897822 /nfs/dbraw/zinc/89/78/22/1036897822.db2.gz GGBBTVQRXLNXBN-MRXNPFEDSA-N 1 1 334.322 4.086 20 5 EIBDMO CC[N@H+](Cc1cccc(Cl)c1)Cc1cc([N+](=O)[O-])ccc1OC ZINC000061253798 1036971605 /nfs/dbraw/zinc/97/16/05/1036971605.db2.gz UEBHXCIBLQQNBS-UHFFFAOYSA-N 1 1 334.803 4.279 20 5 EIBDMO CC[N@@H+](Cc1cccc(Cl)c1)Cc1cc([N+](=O)[O-])ccc1OC ZINC000061253798 1036971625 /nfs/dbraw/zinc/97/16/25/1036971625.db2.gz UEBHXCIBLQQNBS-UHFFFAOYSA-N 1 1 334.803 4.279 20 5 EIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@@H](c3ccco3)C2)c1 ZINC000590160021 1036998716 /nfs/dbraw/zinc/99/87/16/1036998716.db2.gz ZZPCPCGYJPNRHU-LLVKDONJSA-N 1 1 340.301 4.196 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C2CC2)cc1 ZINC000603838853 1037022329 /nfs/dbraw/zinc/02/23/29/1037022329.db2.gz RJHJCHQBASNOBV-UHFFFAOYSA-N 1 1 326.396 4.076 20 5 EIBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccc2ccccc2c1 ZINC000603844753 1037036258 /nfs/dbraw/zinc/03/62/58/1037036258.db2.gz XKNPDQBURSQSAW-UHFFFAOYSA-N 1 1 336.391 4.259 20 5 EIBDMO CCC[N@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)Cc1ccccc1F ZINC000604493340 1037407471 /nfs/dbraw/zinc/40/74/71/1037407471.db2.gz RPOCOADECCEOIH-UHFFFAOYSA-N 1 1 332.375 4.155 20 5 EIBDMO CCC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)Cc1ccccc1F ZINC000604493340 1037407479 /nfs/dbraw/zinc/40/74/79/1037407479.db2.gz RPOCOADECCEOIH-UHFFFAOYSA-N 1 1 332.375 4.155 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCOc1ccc(Cl)cc1 ZINC000061779242 1037543662 /nfs/dbraw/zinc/54/36/62/1037543662.db2.gz FUBGWQSATDDTAI-CYBMUJFWSA-N 1 1 334.803 4.320 20 5 EIBDMO COc1cc(C[N@@H+](Cc2ccccc2C)C2CC2)ccc1[N+](=O)[O-] ZINC000489134892 1037878425 /nfs/dbraw/zinc/87/84/25/1037878425.db2.gz FVJZIOGCBBVCFG-UHFFFAOYSA-N 1 1 326.396 4.076 20 5 EIBDMO COc1ccccc1CC[N@@H+](C)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000489223910 1037897363 /nfs/dbraw/zinc/89/73/63/1037897363.db2.gz LFWRUPBPYSEJJO-OAHLLOKOSA-N 1 1 328.412 4.147 20 5 EIBDMO C[C@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1ccccc1[N+](=O)[O-] ZINC000594722438 1038394362 /nfs/dbraw/zinc/39/43/62/1038394362.db2.gz PWWROGBPKDZWMW-LBPRGKRZSA-N 1 1 330.359 4.126 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+]Cc2cccc(OC3CC3)c2F)cc1[N+](=O)[O-] ZINC000594942818 1038499759 /nfs/dbraw/zinc/49/97/59/1038499759.db2.gz ZRUIEPRQPNADSP-ZDUSSCGKSA-N 1 1 344.386 4.434 20 5 EIBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CC[C@@H](c3ccccc3F)C2)c(F)c1 ZINC000555582595 1039401958 /nfs/dbraw/zinc/40/19/58/1039401958.db2.gz CPHARFNIBCWNQX-LLVKDONJSA-N 1 1 336.313 4.002 20 5 EIBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CC[C@@H](c3ccccc3F)C2)c(F)c1 ZINC000555582595 1039401967 /nfs/dbraw/zinc/40/19/67/1039401967.db2.gz CPHARFNIBCWNQX-LLVKDONJSA-N 1 1 336.313 4.002 20 5 EIBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCc2cccnc21 ZINC000481416566 1039403614 /nfs/dbraw/zinc/40/36/14/1039403614.db2.gz PWSJHUPFLNVUFT-GOSISDBHSA-N 1 1 325.412 4.279 20 5 EIBDMO C[C@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H](C)C1 ZINC000535545420 1040348366 /nfs/dbraw/zinc/34/83/66/1040348366.db2.gz KLRZDAIRDNCPPC-KBPBESRZSA-N 1 1 329.400 4.118 20 5 EIBDMO C[C@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H](C)C1 ZINC000535545430 1040349080 /nfs/dbraw/zinc/34/90/80/1040349080.db2.gz KLRZDAIRDNCPPC-UONOGXRCSA-N 1 1 329.400 4.118 20 5 EIBDMO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1cccc(Cl)c1 ZINC000482685775 1040428082 /nfs/dbraw/zinc/42/80/82/1040428082.db2.gz YZRODLQKSYLQPZ-UHFFFAOYSA-N 1 1 344.802 4.147 20 5 EIBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1cccc(Cl)c1 ZINC000482685775 1040428088 /nfs/dbraw/zinc/42/80/88/1040428088.db2.gz YZRODLQKSYLQPZ-UHFFFAOYSA-N 1 1 344.802 4.147 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000539807243 1040802638 /nfs/dbraw/zinc/80/26/38/1040802638.db2.gz ZGTDWBAKZDITBS-TZMCWYRMSA-N 1 1 346.349 4.008 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000539807243 1040802641 /nfs/dbraw/zinc/80/26/41/1040802641.db2.gz ZGTDWBAKZDITBS-TZMCWYRMSA-N 1 1 346.349 4.008 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCO[C@@H](c2ccccc2C)C1 ZINC000539808790 1040804699 /nfs/dbraw/zinc/80/46/99/1040804699.db2.gz XCHKOMKNEBVROL-OXJNMPFZSA-N 1 1 340.423 4.346 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCO[C@@H](c2ccccc2C)C1 ZINC000539808790 1040804702 /nfs/dbraw/zinc/80/47/02/1040804702.db2.gz XCHKOMKNEBVROL-OXJNMPFZSA-N 1 1 340.423 4.346 20 5 EIBDMO CO[C@@H](C)C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C ZINC000539818715 1040811008 /nfs/dbraw/zinc/81/10/08/1040811008.db2.gz HXAVJNMUHHRQFN-AWEZNQCLSA-N 1 1 332.400 4.100 20 5 EIBDMO CCOc1cc(NCc2cccc(C[N@@H+](C)CC)c2)ccc1[N+](=O)[O-] ZINC000537767382 1040814955 /nfs/dbraw/zinc/81/49/55/1040814955.db2.gz OHBSNAHHMDETEP-UHFFFAOYSA-N 1 1 343.427 4.057 20 5 EIBDMO C[C@@H](O)C[C@H]1CCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000539828626 1040822774 /nfs/dbraw/zinc/82/27/74/1040822774.db2.gz FGJNXXVXICONTJ-ZIAGYGMSSA-N 1 1 346.452 4.059 20 5 EIBDMO C[C@@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1C ZINC000539825897 1040822834 /nfs/dbraw/zinc/82/28/34/1040822834.db2.gz XRMPGKKHASICCW-CHWSQXEVSA-N 1 1 331.441 4.196 20 5 EIBDMO Cc1cc(NCc2ccccc2C[N@H+](C)C(C)C)ccc1[N+](=O)[O-] ZINC000515551161 1040849292 /nfs/dbraw/zinc/84/92/92/1040849292.db2.gz DAPWPWAOBKZPHE-UHFFFAOYSA-N 1 1 327.428 4.356 20 5 EIBDMO CC(C)c1ccc(CN[C@H]2CC[N@@H+](CC3CCCC3)C2)cc1[N+](=O)[O-] ZINC000462748627 1040896364 /nfs/dbraw/zinc/89/63/64/1040896364.db2.gz DSTYMPLQZDGQBH-SFHVURJKSA-N 1 1 345.487 4.072 20 5 EIBDMO CC(C)c1ccc(C[NH2+][C@H]2CCN(CC3CCCC3)C2)cc1[N+](=O)[O-] ZINC000462748627 1040896369 /nfs/dbraw/zinc/89/63/69/1040896369.db2.gz DSTYMPLQZDGQBH-SFHVURJKSA-N 1 1 345.487 4.072 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+][C@H]2c3ccc(F)cc3O[C@@H]2C)cc1[N+](=O)[O-] ZINC000554374090 1041058590 /nfs/dbraw/zinc/05/85/90/1041058590.db2.gz POPOTGAZFYJXDG-VNBZBWLYSA-N 1 1 330.359 4.215 20 5 EIBDMO CC[C@@H]1CC[C@@H](C)[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000540055682 1041077997 /nfs/dbraw/zinc/07/79/97/1041077997.db2.gz KARZZHQZLLMPKP-UKRRQHHQSA-N 1 1 329.400 4.055 20 5 EIBDMO C[C@@H](NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000436310524 1041098810 /nfs/dbraw/zinc/09/88/10/1041098810.db2.gz RMNMNECFZPGYJX-BEFAXECRSA-N 1 1 331.460 4.043 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425554046 1041250771 /nfs/dbraw/zinc/25/07/71/1041250771.db2.gz NVNCMZAVJALWFT-HNAYVOBHSA-N 1 1 344.455 4.245 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(N[C@@H](Cc2[nH+]ccn2C)c2ccccc2)c1 ZINC000088726383 1041693575 /nfs/dbraw/zinc/69/35/75/1041693575.db2.gz KPISJEZKKVSUPO-INIZCTEOSA-N 1 1 336.395 4.033 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cc3c(cccc3F)[nH]2)C2CC2)c1 ZINC000437575175 1041844280 /nfs/dbraw/zinc/84/42/80/1041844280.db2.gz HIPFKEMSSPCNHY-UHFFFAOYSA-N 1 1 339.370 4.380 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cc3c(cccc3F)[nH]2)C2CC2)c1 ZINC000437575175 1041844283 /nfs/dbraw/zinc/84/42/83/1041844283.db2.gz HIPFKEMSSPCNHY-UHFFFAOYSA-N 1 1 339.370 4.380 20 5 EIBDMO COc1cccc(F)c1[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000122462436 1042136990 /nfs/dbraw/zinc/13/69/90/1042136990.db2.gz YNUWVSBQQPXAII-CHWSQXEVSA-N 1 1 332.375 4.463 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H](C)C[C@@H]1c1ccccc1F ZINC000464725058 1042141251 /nfs/dbraw/zinc/14/12/51/1042141251.db2.gz LNVLPKBCIQYGEP-SCLBCKFNSA-N 1 1 344.386 4.326 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](C)C[C@@H]1c1ccccc1F ZINC000464725058 1042141258 /nfs/dbraw/zinc/14/12/58/1042141258.db2.gz LNVLPKBCIQYGEP-SCLBCKFNSA-N 1 1 344.386 4.326 20 5 EIBDMO C[C@@H]1C[C@@H](c2ccccc2F)[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000464729084 1042141902 /nfs/dbraw/zinc/14/19/02/1042141902.db2.gz ZGUSGFVDSNJEPY-KUHUBIRLSA-N 1 1 328.387 4.360 20 5 EIBDMO CCC(CC)n1ccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)n1 ZINC000271756218 1042313475 /nfs/dbraw/zinc/31/34/75/1042313475.db2.gz DQFVUWXQUDVZEE-CQSZACIVSA-N 1 1 330.432 4.312 20 5 EIBDMO COc1ccccc1[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000108421261 1042411935 /nfs/dbraw/zinc/41/19/35/1042411935.db2.gz AIXAUSDBKLGJDY-NRFANRHFSA-N 1 1 348.402 4.483 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000506482776 1042497361 /nfs/dbraw/zinc/49/73/61/1042497361.db2.gz UOXDJYWZXZCNFT-KZNAEPCWSA-N 1 1 345.487 4.242 20 5 EIBDMO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000491856247 1042507675 /nfs/dbraw/zinc/50/76/75/1042507675.db2.gz AHXBLGVOKVTAAR-SFHVURJKSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000491856247 1042507681 /nfs/dbraw/zinc/50/76/81/1042507681.db2.gz AHXBLGVOKVTAAR-SFHVURJKSA-N 1 1 330.359 4.080 20 5 EIBDMO CC(C)([NH2+]Cc1cnc(C(F)(F)F)s1)c1ccccc1[N+](=O)[O-] ZINC000492308096 1042609600 /nfs/dbraw/zinc/60/96/00/1042609600.db2.gz AMWWBQOAVLUPOD-UHFFFAOYSA-N 1 1 345.346 4.095 20 5 EIBDMO CCOc1cc(C[N@@H+](Cc2cccs2)C2CC2)ccc1[N+](=O)[O-] ZINC000492372059 1042631761 /nfs/dbraw/zinc/63/17/61/1042631761.db2.gz AYOORWTVZFGDEZ-UHFFFAOYSA-N 1 1 332.425 4.220 20 5 EIBDMO COc1cccc(C2CC[NH+](Cc3c(F)cccc3[N+](=O)[O-])CC2)c1 ZINC000506586122 1042641124 /nfs/dbraw/zinc/64/11/24/1042641124.db2.gz YBVSLAIDRBEHMJ-UHFFFAOYSA-N 1 1 344.386 4.122 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@@H](C)Cc1ccsc1 ZINC000426491895 1042763187 /nfs/dbraw/zinc/76/31/87/1042763187.db2.gz LEMNNSYGYCYCQJ-ZDUSSCGKSA-N 1 1 334.441 4.118 20 5 EIBDMO COc1cccc([C@@H]2CCC[N@H+]2Cc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000506690634 1042780560 /nfs/dbraw/zinc/78/05/60/1042780560.db2.gz QZCBPTLJNJJBBM-SFHVURJKSA-N 1 1 326.396 4.249 20 5 EIBDMO COc1ccc([C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])c(Cl)c3)C2)cc1 ZINC000761507837 1042872636 /nfs/dbraw/zinc/87/26/36/1042872636.db2.gz YRWDVUZWPCCZOO-HNNXBMFYSA-N 1 1 346.814 4.246 20 5 EIBDMO CC(C)(C)OC1CC[NH+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000761505937 1042873794 /nfs/dbraw/zinc/87/37/94/1042873794.db2.gz JAUUPRGLRCIACQ-UHFFFAOYSA-N 1 1 326.824 4.028 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCS[C@H]3CCCC[C@H]32)cc1Cl ZINC000761513605 1042874297 /nfs/dbraw/zinc/87/42/97/1042874297.db2.gz AXKAMLYGJPVZBV-CABCVRRESA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCS[C@H]3CCCC[C@H]32)cc1Cl ZINC000761513605 1042874299 /nfs/dbraw/zinc/87/42/99/1042874299.db2.gz AXKAMLYGJPVZBV-CABCVRRESA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](COc3ccccc3)C2)cc1Cl ZINC000761532642 1042876986 /nfs/dbraw/zinc/87/69/86/1042876986.db2.gz MFVZZTKDSREBEJ-OAHLLOKOSA-N 1 1 346.814 4.149 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](COc3ccccc3)C2)cc1Cl ZINC000761532642 1042876987 /nfs/dbraw/zinc/87/69/87/1042876987.db2.gz MFVZZTKDSREBEJ-OAHLLOKOSA-N 1 1 346.814 4.149 20 5 EIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCS[C@@H]2CCCC[C@@H]21 ZINC000493312628 1042895445 /nfs/dbraw/zinc/89/54/45/1042895445.db2.gz ZFMPWBRUOVMUPI-LSDHHAIUSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCS[C@@H]2CCCC[C@@H]21 ZINC000493312628 1042895446 /nfs/dbraw/zinc/89/54/46/1042895446.db2.gz ZFMPWBRUOVMUPI-LSDHHAIUSA-N 1 1 326.849 4.108 20 5 EIBDMO C[N@@H+](Cc1ccc(OC(F)(F)F)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC000603497600 1043187275 /nfs/dbraw/zinc/18/72/75/1043187275.db2.gz MWMNYBPOELMVOI-UHFFFAOYSA-N 1 1 340.301 4.125 20 5 EIBDMO C[C@H](C1CC1)[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CC1 ZINC000507995643 1043230459 /nfs/dbraw/zinc/23/04/59/1043230459.db2.gz VHPCMPJBEJBQLX-GFCCVEGCSA-N 1 1 343.452 4.481 20 5 EIBDMO O=[N+]([O-])c1cccc(C[NH+]2CCC(c3ncccc3Cl)CC2)c1 ZINC000429199367 1043291767 /nfs/dbraw/zinc/29/17/67/1043291767.db2.gz AJJXBSCEFMAUFG-UHFFFAOYSA-N 1 1 331.803 4.023 20 5 EIBDMO CC(C)(O)[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000428070331 1043316728 /nfs/dbraw/zinc/31/67/28/1043316728.db2.gz NWEVHJZIUGHHKU-KRWDZBQOSA-N 1 1 346.452 4.059 20 5 EIBDMO Cc1cc(N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c(Cl)cc1[N+](=O)[O-] ZINC000301769486 1043344169 /nfs/dbraw/zinc/34/41/69/1043344169.db2.gz INTCUQBYEXMJKZ-CJNGLKHVSA-N 1 1 349.862 4.010 20 5 EIBDMO Cc1ccc(C[NH2+]Cc2ccsc2Br)cc1[N+](=O)[O-] ZINC000388561917 1043356208 /nfs/dbraw/zinc/35/62/08/1043356208.db2.gz NVGHJCRNCPLCNG-UHFFFAOYSA-N 1 1 341.230 4.017 20 5 EIBDMO O=[N+]([O-])c1ccc(CC[NH+](Cc2ccco2)Cc2ccco2)cc1 ZINC000059386766 1043356867 /nfs/dbraw/zinc/35/68/67/1043356867.db2.gz KEYWUCGDBVKGAJ-UHFFFAOYSA-N 1 1 326.352 4.026 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3ncccc3Cl)CC2)cc1 ZINC000429218371 1043363292 /nfs/dbraw/zinc/36/32/92/1043363292.db2.gz UZYUOXOHQJOHNA-UHFFFAOYSA-N 1 1 331.803 4.023 20 5 EIBDMO CC[NH+](CC)C[C@@H](C)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000520959581 1043450687 /nfs/dbraw/zinc/45/06/87/1043450687.db2.gz TXFXKQBLYFZXMQ-CQSZACIVSA-N 1 1 347.484 4.143 20 5 EIBDMO CC(C)([NH2+]Cc1cc(-c2ccccc2)no1)c1ccccc1[N+](=O)[O-] ZINC000429234246 1043801340 /nfs/dbraw/zinc/80/13/40/1043801340.db2.gz BDAGNNCJDXRZTQ-UHFFFAOYSA-N 1 1 337.379 4.275 20 5 EIBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)cc1 ZINC000732988572 1044063199 /nfs/dbraw/zinc/06/31/99/1044063199.db2.gz IUXHUGRIUFBCBI-GOSISDBHSA-N 1 1 332.350 4.253 20 5 EIBDMO Cc1cc[nH+]c(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000131015839 1044075136 /nfs/dbraw/zinc/07/51/36/1044075136.db2.gz GXZYSESHOOWPBK-UHFFFAOYSA-N 1 1 326.381 4.034 20 5 EIBDMO Cc1ccccc1[C@H]([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)C1CC1 ZINC000509007252 1044156199 /nfs/dbraw/zinc/15/61/99/1044156199.db2.gz PUFHDBNHPOIUSP-GOSISDBHSA-N 1 1 332.350 4.422 20 5 EIBDMO CC(C)(C)Oc1cccc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])n1 ZINC000429245273 1044176364 /nfs/dbraw/zinc/17/63/64/1044176364.db2.gz OHCQUPBEKTWFFA-UHFFFAOYSA-N 1 1 343.427 4.192 20 5 EIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](C)C[C@H](C)C1 ZINC000246483828 1044317313 /nfs/dbraw/zinc/31/73/13/1044317313.db2.gz AHOHHBNAHXWVSK-HZSPNIEDSA-N 1 1 344.415 4.074 20 5 EIBDMO Cc1ccc(C[NH2+][C@H](C)c2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000734163656 1044508641 /nfs/dbraw/zinc/50/86/41/1044508641.db2.gz FBHYROZJKXTTLK-GFCCVEGCSA-N 1 1 327.409 4.364 20 5 EIBDMO CC(C)[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)CC1CCC1 ZINC000193202492 1044739945 /nfs/dbraw/zinc/73/99/45/1044739945.db2.gz IAGMZNVRACXTON-UHFFFAOYSA-N 1 1 329.400 4.260 20 5 EIBDMO CC[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccccn1 ZINC000124799649 1044895071 /nfs/dbraw/zinc/89/50/71/1044895071.db2.gz KEWXMZJXOMWAGE-UHFFFAOYSA-N 1 1 337.379 4.272 20 5 EIBDMO CC(C)C[C@@H]1CCCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000466670828 1044956762 /nfs/dbraw/zinc/95/67/62/1044956762.db2.gz KAVFPBJGLPSFQB-HNNXBMFYSA-N 1 1 344.415 4.045 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1ccccc1N1CCCC1 ZINC000543632451 1044994392 /nfs/dbraw/zinc/99/43/92/1044994392.db2.gz URPOALZJXBSTSW-UHFFFAOYSA-N 1 1 339.439 4.135 20 5 EIBDMO Cc1cc(C[NH2+][C@@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)on1 ZINC000125495858 1045007709 /nfs/dbraw/zinc/00/77/09/1045007709.db2.gz CMQCZPYGJGFRLY-LBPRGKRZSA-N 1 1 343.408 4.471 20 5 EIBDMO COc1ccccc1[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000738340714 1045052469 /nfs/dbraw/zinc/05/24/69/1045052469.db2.gz ONSSJEUDFOZEQF-ZDUSSCGKSA-N 1 1 346.814 4.246 20 5 EIBDMO Cc1ccccc1[C@H]1C[C@@H](C)[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000738312440 1045055789 /nfs/dbraw/zinc/05/57/89/1045055789.db2.gz OKNJWKLHEWEJSU-CABCVRRESA-N 1 1 328.387 4.420 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@H]1CCOc2ccccc21)C1CC1 ZINC000611254797 1045266603 /nfs/dbraw/zinc/26/66/03/1045266603.db2.gz MHULKYBJOPZFMN-OAHLLOKOSA-N 1 1 338.407 4.126 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CC=C(c3c[nH]c4ccccc43)CC2)cs1 ZINC000194237751 1045681879 /nfs/dbraw/zinc/68/18/79/1045681879.db2.gz PQGPTVOFOFVGFT-UHFFFAOYSA-N 1 1 339.420 4.427 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC=C(c3c[nH]c4ccccc43)CC2)cs1 ZINC000194237751 1045681891 /nfs/dbraw/zinc/68/18/91/1045681891.db2.gz PQGPTVOFOFVGFT-UHFFFAOYSA-N 1 1 339.420 4.427 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCS[C@H]3CCCC[C@H]32)ccc1Cl ZINC000768549104 1045822636 /nfs/dbraw/zinc/82/26/36/1045822636.db2.gz OPIPHDRERLYUHD-HIFRSBDPSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCS[C@H]3CCCC[C@H]32)ccc1Cl ZINC000768549104 1045822640 /nfs/dbraw/zinc/82/26/40/1045822640.db2.gz OPIPHDRERLYUHD-HIFRSBDPSA-N 1 1 326.849 4.108 20 5 EIBDMO O=C1CCCN1[C@@H]1CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000792187504 1045877151 /nfs/dbraw/zinc/87/71/51/1045877151.db2.gz SBBALSBYABIGHH-LJQANCHMSA-N 1 1 344.458 4.190 20 5 EIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@@H](c2c(F)cccc2F)C1 ZINC000769229063 1045898200 /nfs/dbraw/zinc/89/82/00/1045898200.db2.gz UUAVBBDGBSFHJG-LLVKDONJSA-N 1 1 336.313 4.002 20 5 EIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CC[C@@H](c2c(F)cccc2F)C1 ZINC000769229063 1045898197 /nfs/dbraw/zinc/89/81/97/1045898197.db2.gz UUAVBBDGBSFHJG-LLVKDONJSA-N 1 1 336.313 4.002 20 5 EIBDMO CC(C)[N@H+](Cc1c(Br)cccc1[N+](=O)[O-])C1CCC1 ZINC000769469605 1045984638 /nfs/dbraw/zinc/98/46/38/1045984638.db2.gz AZGVRAZAOVAHCM-UHFFFAOYSA-N 1 1 327.222 4.120 20 5 EIBDMO CC(C)[N@@H+](Cc1c(Br)cccc1[N+](=O)[O-])C1CCC1 ZINC000769469605 1045984649 /nfs/dbraw/zinc/98/46/49/1045984649.db2.gz AZGVRAZAOVAHCM-UHFFFAOYSA-N 1 1 327.222 4.120 20 5 EIBDMO COc1ccc(C[C@H](C)[N@@H+]2Cc3ccccc3[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC001170329597 1046002058 /nfs/dbraw/zinc/00/20/58/1046002058.db2.gz SBAYMLUSJUNZFY-GJZGRUSLSA-N 1 1 340.423 4.154 20 5 EIBDMO COc1ccc(C[C@H](C)[N@@H+](C)CCc2cccc(C)c2)c([N+](=O)[O-])c1 ZINC001170345255 1046020698 /nfs/dbraw/zinc/02/06/98/1046020698.db2.gz JBUIARYKJFAYSJ-INIZCTEOSA-N 1 1 342.439 4.017 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@]2(C)[C@H](C1)C2(Cl)Cl ZINC000792914817 1046107092 /nfs/dbraw/zinc/10/70/92/1046107092.db2.gz XURYUQGBDIBTFZ-DDTOSNHZSA-N 1 1 329.227 4.172 20 5 EIBDMO CCSCC[C@@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000536671785 1046657545 /nfs/dbraw/zinc/65/75/45/1046657545.db2.gz YOJUFNORQJHDTB-LLVKDONJSA-N 1 1 348.415 4.160 20 5 EIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000536676555 1046661365 /nfs/dbraw/zinc/66/13/65/1046661365.db2.gz SEZQKLSYTZQROJ-MOTZXUDYSA-N 1 1 330.428 4.032 20 5 EIBDMO COc1cc(C[N@H+]2CCC[C@@H](c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC001170481928 1046900642 /nfs/dbraw/zinc/90/06/42/1046900642.db2.gz YHPZIEWSKUTCKJ-OAHLLOKOSA-N 1 1 344.386 4.122 20 5 EIBDMO Cc1ccccc1[C@H]1CCC[N@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000917481992 1046902257 /nfs/dbraw/zinc/90/22/57/1046902257.db2.gz ASGLGRDEMFZTMG-LJQANCHMSA-N 1 1 336.395 4.048 20 5 EIBDMO CCCO[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000746666795 1046976137 /nfs/dbraw/zinc/97/61/37/1046976137.db2.gz VJTPIILGSKYUQH-HNNXBMFYSA-N 1 1 326.824 4.029 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2Cc2cccc(F)c2)cc1F ZINC000788475620 1047197789 /nfs/dbraw/zinc/19/77/89/1047197789.db2.gz HBNIFFQVNPUCMN-INIZCTEOSA-N 1 1 332.350 4.080 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@@H]3CF)o2)c(Cl)c1 ZINC000556949908 1048313418 /nfs/dbraw/zinc/31/34/18/1048313418.db2.gz GTPJJPZHPAIARO-GFCCVEGCSA-N 1 1 338.766 4.442 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@H]3CF)o2)c(Cl)c1 ZINC000556949908 1048313428 /nfs/dbraw/zinc/31/34/28/1048313428.db2.gz GTPJJPZHPAIARO-GFCCVEGCSA-N 1 1 338.766 4.442 20 5 EIBDMO Cc1csc(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)n1 ZINC000195235670 1048428153 /nfs/dbraw/zinc/42/81/53/1048428153.db2.gz WQNAITJTLWOHOO-UHFFFAOYSA-N 1 1 345.449 4.378 20 5 EIBDMO CC[C@@H](Nc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2)c1ccccc1C ZINC001171201980 1048756182 /nfs/dbraw/zinc/75/61/82/1048756182.db2.gz VUJQLPSEZAZUOD-GOSISDBHSA-N 1 1 339.439 4.454 20 5 EIBDMO CC[C@@H](Nc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2)c1ccccc1C ZINC001171201980 1048756187 /nfs/dbraw/zinc/75/61/87/1048756187.db2.gz VUJQLPSEZAZUOD-GOSISDBHSA-N 1 1 339.439 4.454 20 5 EIBDMO CC(C)([NH2+]Cc1ccnc(Cl)c1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000811490800 1049086521 /nfs/dbraw/zinc/08/65/21/1049086521.db2.gz VDSXDLIWVKJFSF-UHFFFAOYSA-N 1 1 340.210 4.322 20 5 EIBDMO Cc1ccc([C@H]2CSCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000609706107 1049278327 /nfs/dbraw/zinc/27/83/27/1049278327.db2.gz XNZVCWFXJPGJCP-LJQANCHMSA-N 1 1 342.464 4.236 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(c2ccccc2F)CC1 ZINC000609895299 1049386862 /nfs/dbraw/zinc/38/68/62/1049386862.db2.gz LFXFUOSVAFJLIO-UHFFFAOYSA-N 1 1 344.386 4.122 20 5 EIBDMO CCCC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCC[C@H](C)C1 ZINC001170683709 1049542051 /nfs/dbraw/zinc/54/20/51/1049542051.db2.gz SZZXNQUQSCGXAB-SNRMKQJTSA-N 1 1 334.460 4.309 20 5 EIBDMO CN(C(=O)c1c2ccccc2cc2ccccc21)[C@H]1CCC[N@@H+](C)C1 ZINC000813025478 1049661897 /nfs/dbraw/zinc/66/18/97/1049661897.db2.gz RXTWVZUTRCTQPW-SFHVURJKSA-N 1 1 332.447 4.159 20 5 EIBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[C@@H]1c1ccccc1 ZINC001171018510 1049852184 /nfs/dbraw/zinc/85/21/84/1049852184.db2.gz PXPINNOUMNDEAI-WOJBJXKFSA-N 1 1 340.423 4.242 20 5 EIBDMO C[N@@H+](Cc1ccc(Cl)nc1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172922641 1050235403 /nfs/dbraw/zinc/23/54/03/1050235403.db2.gz ZUCYICHDLMFGGO-MRXNPFEDSA-N 1 1 345.830 4.023 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCC[C@H]1c1cccnc1)CC2 ZINC001172910382 1050246496 /nfs/dbraw/zinc/24/64/96/1050246496.db2.gz YJKFXNMIFUTZED-QUCCMNQESA-N 1 1 337.423 4.074 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1cccc2cccnc21 ZINC001173226415 1050356678 /nfs/dbraw/zinc/35/66/78/1050356678.db2.gz KBXNWZYGTPWZPA-HNNXBMFYSA-N 1 1 335.407 4.206 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](Oc2ccccc2)C1 ZINC001173224949 1050357853 /nfs/dbraw/zinc/35/78/53/1050357853.db2.gz AASMJKPGVIJDIZ-OXJNMPFZSA-N 1 1 340.423 4.069 20 5 EIBDMO COc1cccc([C@@H]2CC[N@H+]([C@H](C)Cc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC001173231931 1050359901 /nfs/dbraw/zinc/35/99/01/1050359901.db2.gz OZKWTDOOHDYGQX-CRAIPNDOSA-N 1 1 340.423 4.024 20 5 EIBDMO CC(C)Cc1ncc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)s1 ZINC001178171061 1050408705 /nfs/dbraw/zinc/40/87/05/1050408705.db2.gz OBPUFFZILYGCEG-UHFFFAOYSA-N 1 1 339.848 4.193 20 5 EIBDMO CCOc1ccc(NC/C(C)=C\c2cccc([N+](=O)[O-])c2)[nH+]c1C ZINC001179232718 1050655201 /nfs/dbraw/zinc/65/52/01/1050655201.db2.gz ONFALEMZMCINBP-RAXLEYEMSA-N 1 1 327.384 4.212 20 5 EIBDMO CC(C)(C)c1ccc(CC[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC001180267133 1050940859 /nfs/dbraw/zinc/94/08/59/1050940859.db2.gz OZFRWVWHVXQIKE-UHFFFAOYSA-N 1 1 338.451 4.493 20 5 EIBDMO Cc1ccccc1OCC[N@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC001180444524 1050993357 /nfs/dbraw/zinc/99/33/57/1050993357.db2.gz HPYAEIRQSQPKNM-UHFFFAOYSA-N 1 1 334.803 4.067 20 5 EIBDMO CCOc1ccc(C[N@@H+](C)Cc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC001180489272 1051004765 /nfs/dbraw/zinc/00/47/65/1051004765.db2.gz XJBLPQXMHNSBFQ-UHFFFAOYSA-N 1 1 328.412 4.242 20 5 EIBDMO Cc1ccc([C@H](C)N[C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000183198142 1051010415 /nfs/dbraw/zinc/01/04/15/1051010415.db2.gz FAWKMXGWSSTDMM-XYJFISCASA-N 1 1 345.487 4.207 20 5 EIBDMO Cc1ccc([C@H](C)N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000183198142 1051010428 /nfs/dbraw/zinc/01/04/28/1051010428.db2.gz FAWKMXGWSSTDMM-XYJFISCASA-N 1 1 345.487 4.207 20 5 EIBDMO Cc1ccc([C@H](C)N[C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000183198190 1051012542 /nfs/dbraw/zinc/01/25/42/1051012542.db2.gz FAWKMXGWSSTDMM-LZLYRXPVSA-N 1 1 345.487 4.207 20 5 EIBDMO Cc1ccc([C@H](C)N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000183198190 1051012554 /nfs/dbraw/zinc/01/25/54/1051012554.db2.gz FAWKMXGWSSTDMM-LZLYRXPVSA-N 1 1 345.487 4.207 20 5 EIBDMO COc1cccc([C@@]2(C)CC[N@@H+](Cc3ccc(C)c([N+](=O)[O-])c3)C2)c1 ZINC001174583809 1051069157 /nfs/dbraw/zinc/06/91/57/1051069157.db2.gz YLDUXAHCLLTWKX-FQEVSTJZSA-N 1 1 340.423 4.075 20 5 EIBDMO CC(C)[C@@H]1CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001180950527 1051119400 /nfs/dbraw/zinc/11/94/00/1051119400.db2.gz BWNJRRMFORTBLF-GFCCVEGCSA-N 1 1 330.350 4.482 20 5 EIBDMO O=[N+]([O-])c1ccc([O-])cc1CN(Cc1ccccc1)CC1CCC1 ZINC001190503111 1051196435 /nfs/dbraw/zinc/19/64/35/1051196435.db2.gz LMYRBZROPBIXQO-UHFFFAOYSA-N 1 1 326.396 4.103 20 5 EIBDMO C[C@@H]1C[C@@H](C(C)(C)C)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC001182182846 1051412569 /nfs/dbraw/zinc/41/25/69/1051412569.db2.gz FTUVYVUGUJIMKH-OLZOCXBDSA-N 1 1 331.416 4.383 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)c(Cl)c1 ZINC001191359337 1051440406 /nfs/dbraw/zinc/44/04/06/1051440406.db2.gz UNZRQPIFMHJUOB-LSDHHAIUSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)c(Cl)c1 ZINC001191359337 1051440416 /nfs/dbraw/zinc/44/04/16/1051440416.db2.gz UNZRQPIFMHJUOB-LSDHHAIUSA-N 1 1 326.849 4.108 20 5 EIBDMO COc1ccc(C[N@H+]2CC[C@H](Cc3ccccc3)[C@H]2C)cc1[N+](=O)[O-] ZINC001191475991 1051461897 /nfs/dbraw/zinc/46/18/97/1051461897.db2.gz QQDOYBCCPOXBEH-CRAIPNDOSA-N 1 1 340.423 4.057 20 5 EIBDMO C[C@@H]1C[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CC(C)(C)C1 ZINC001192502049 1051748861 /nfs/dbraw/zinc/74/88/61/1051748861.db2.gz RORAIBIYJFYLSP-NSHDSACASA-N 1 1 341.249 4.225 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CC(C)(C)C1 ZINC001192502049 1051748878 /nfs/dbraw/zinc/74/88/78/1051748878.db2.gz RORAIBIYJFYLSP-NSHDSACASA-N 1 1 341.249 4.225 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCCSC[C@@H]1c1ccccc1 ZINC001175769144 1051774194 /nfs/dbraw/zinc/77/41/94/1051774194.db2.gz PWIRHMONZFACAI-GOSISDBHSA-N 1 1 328.437 4.275 20 5 EIBDMO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1cccc([N+](=O)[O-])c1 ZINC001192803955 1051812430 /nfs/dbraw/zinc/81/24/30/1051812430.db2.gz XLWYTOUUJGQNRE-INIZCTEOSA-N 1 1 349.774 4.397 20 5 EIBDMO CC[C@H]1Cc2ccccc2C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC001193117736 1051873064 /nfs/dbraw/zinc/87/30/64/1051873064.db2.gz PJKFXLVNZYYLPE-SFHVURJKSA-N 1 1 340.423 4.201 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](c2nc(C)cs2)C1 ZINC001183671482 1051881012 /nfs/dbraw/zinc/88/10/12/1051881012.db2.gz ILLWEKXQEUVUOU-LPDYGMJQSA-N 1 1 343.452 4.253 20 5 EIBDMO CC(C)[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC001193497561 1051934180 /nfs/dbraw/zinc/93/41/80/1051934180.db2.gz RSFBQJRDXFSJMC-GFCCVEGCSA-N 1 1 330.350 4.482 20 5 EIBDMO CN(c1ccccc1)c1ccc(C[NH2+]Cc2ccccn2)cc1[N+](=O)[O-] ZINC000072713234 1052575276 /nfs/dbraw/zinc/57/52/76/1052575276.db2.gz IDAVNBYANOHTKU-UHFFFAOYSA-N 1 1 348.406 4.048 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@H](c1ccccc1)[C@@H](O)c1ccccc1 ZINC000794670160 1053241606 /nfs/dbraw/zinc/24/16/06/1053241606.db2.gz HPKQWPHWOQPWJB-RTWAWAEBSA-N 1 1 348.402 4.159 20 5 EIBDMO CC[C@@H](C)C[N@@H+](CC)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159434241 1053342336 /nfs/dbraw/zinc/34/23/36/1053342336.db2.gz DHBABMQPLPYEIP-LLVKDONJSA-N 1 1 329.238 4.225 20 5 EIBDMO C[C@@]1(Cc2ccccc2F)CCC[N@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001195464659 1053398274 /nfs/dbraw/zinc/39/82/74/1053398274.db2.gz XZJQCZNPBRCSLG-IBGZPJMESA-N 1 1 346.377 4.470 20 5 EIBDMO CC(C)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccccc1F ZINC000852449346 1053580216 /nfs/dbraw/zinc/58/02/16/1053580216.db2.gz TWJYSUQGDXAMNM-KRWDZBQOSA-N 1 1 347.346 4.129 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]([C@H]3CCCCO3)C2)ccc1Cl ZINC000852595550 1053594829 /nfs/dbraw/zinc/59/48/29/1053594829.db2.gz IGDIZJNUDQEIIM-WMLDXEAASA-N 1 1 338.835 4.029 20 5 EIBDMO CCC(CC)CCC[N@@H+](C)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC001196506255 1053686388 /nfs/dbraw/zinc/68/63/88/1053686388.db2.gz PQKOEYGMRHMMPP-AWEZNQCLSA-N 1 1 335.448 4.070 20 5 EIBDMO C[C@@H](C[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC001196818361 1053780183 /nfs/dbraw/zinc/78/01/83/1053780183.db2.gz JICIULQDQRRDIW-HNNXBMFYSA-N 1 1 347.459 4.072 20 5 EIBDMO C[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])cc2F)[C@H]1c1cccs1 ZINC000301427587 1053923362 /nfs/dbraw/zinc/92/33/62/1053923362.db2.gz PLKQTCYXFUCXKV-SJCJKPOMSA-N 1 1 349.431 4.290 20 5 EIBDMO C[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC001197660396 1053962015 /nfs/dbraw/zinc/96/20/15/1053962015.db2.gz NPUSXRYMCGQCGJ-UGSOOPFHSA-N 1 1 341.367 4.086 20 5 EIBDMO CC(C)(C)OC[C@H]1CCC[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC001197629945 1053966701 /nfs/dbraw/zinc/96/67/01/1053966701.db2.gz KTNMTWGRRSYRJR-CQSZACIVSA-N 1 1 326.824 4.028 20 5 EIBDMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1ccc([N+](=O)[O-])cc1Br ZINC001168570330 1054116486 /nfs/dbraw/zinc/11/64/86/1054116486.db2.gz MWWXAUHFUPBMIS-CMPLNLGQSA-N 1 1 327.222 4.120 20 5 EIBDMO COc1ccc(C[N@H+]2C[C@H](c3ccccc3)CC2(C)C)cc1[N+](=O)[O-] ZINC001198289434 1054116444 /nfs/dbraw/zinc/11/64/44/1054116444.db2.gz OKDKGINNPJQYAI-QGZVFWFLSA-N 1 1 340.423 4.372 20 5 EIBDMO CC[C@@H](C[N@@H+](CC)C[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000775895884 1054279249 /nfs/dbraw/zinc/27/92/49/1054279249.db2.gz OYWFMUPHHUHFPD-JXFKEZNVSA-N 1 1 342.439 4.144 20 5 EIBDMO CCc1noc(C)c1C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872072880 1054379138 /nfs/dbraw/zinc/37/91/38/1054379138.db2.gz KZVWRPBLMWGIAE-SNVBAGLBSA-N 1 1 335.429 4.026 20 5 EIBDMO CC[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCCC[C@@H]1C ZINC000878474783 1055320302 /nfs/dbraw/zinc/32/03/02/1055320302.db2.gz FMQOIDIXOVZRKL-DZGCQCFKSA-N 1 1 344.415 4.045 20 5 EIBDMO CC[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCCC[C@H]1C ZINC000878474789 1055320343 /nfs/dbraw/zinc/32/03/43/1055320343.db2.gz FMQOIDIXOVZRKL-UKRRQHHQSA-N 1 1 344.415 4.045 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ncccc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000091062123 1055511290 /nfs/dbraw/zinc/51/12/90/1055511290.db2.gz UBIXVVUPDMAPRU-LLVKDONJSA-N 1 1 339.317 4.168 20 5 EIBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2nc(C)cs2)cc1[N+](=O)[O-] ZINC000153546032 1055518490 /nfs/dbraw/zinc/51/84/90/1055518490.db2.gz BKOBBROKABXRMO-NEPJUHHUSA-N 1 1 335.429 4.170 20 5 EIBDMO COCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1C)[C@H](C)c1ccccc1 ZINC000542701514 1055842549 /nfs/dbraw/zinc/84/25/49/1055842549.db2.gz FVOIFGXROKMWJA-MRXNPFEDSA-N 1 1 328.412 4.113 20 5 EIBDMO Cc1cccc(NC2CC[NH+](Cc3cc(F)ccc3[N+](=O)[O-])CC2)c1 ZINC000741253877 1058184249 /nfs/dbraw/zinc/18/42/49/1058184249.db2.gz AXNWHBSSVRMCAL-UHFFFAOYSA-N 1 1 343.402 4.119 20 5 EIBDMO Cc1ccc(N2CCC[N@H+]([C@H](C)c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000743843592 1059136453 /nfs/dbraw/zinc/13/64/53/1059136453.db2.gz YXRHXTQKOMJUSI-QGZVFWFLSA-N 1 1 339.439 4.177 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+](C[C@H]2CCCO2)C2CCCC2)c1 ZINC000743851892 1059155616 /nfs/dbraw/zinc/15/56/16/1059155616.db2.gz GWAAZAKTPJOBON-MRXNPFEDSA-N 1 1 338.835 4.172 20 5 EIBDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000743855100 1059161002 /nfs/dbraw/zinc/16/10/02/1059161002.db2.gz YQJCMGJTJGRJFP-KZULUSFZSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000743855100 1059161015 /nfs/dbraw/zinc/16/10/15/1059161015.db2.gz YQJCMGJTJGRJFP-KZULUSFZSA-N 1 1 332.350 4.456 20 5 EIBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)C1 ZINC001169033202 1060587872 /nfs/dbraw/zinc/58/78/72/1060587872.db2.gz BIYHWJQPDBYGNP-SCWSEQNSSA-N 1 1 336.435 4.080 20 5 EIBDMO CC(C)(C)Oc1ccc([C@@H]2CC[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C2)cc1 ZINC001169055820 1060610259 /nfs/dbraw/zinc/61/02/59/1060610259.db2.gz QOGQSFIXGXMLTK-JQHSSLGASA-N 1 1 346.471 4.099 20 5 EIBDMO CCC1(CC)CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC001169301155 1060761105 /nfs/dbraw/zinc/76/11/05/1060761105.db2.gz SRMSHIKONUFOSB-UHFFFAOYSA-N 1 1 330.432 4.263 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC001169834166 1060990392 /nfs/dbraw/zinc/99/03/92/1060990392.db2.gz VCWBSAPJNVYMJN-ZDUSSCGKSA-N 1 1 334.778 4.377 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC001169834165 1060991077 /nfs/dbraw/zinc/99/10/77/1060991077.db2.gz VCWBSAPJNVYMJN-CYBMUJFWSA-N 1 1 334.778 4.377 20 5 EIBDMO C[C@@H]1C[C@@H](C)[C@@H](C)[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000475742975 1032555327 /nfs/dbraw/zinc/55/53/27/1032555327.db2.gz VNJIWMRBVHCOEJ-MGPQQGTHSA-N 1 1 329.400 4.116 20 5 EIBDMO CC[C@H]1CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000509532293 1032783878 /nfs/dbraw/zinc/78/38/78/1032783878.db2.gz JKTUIBDJVKWABB-ZDUSSCGKSA-N 1 1 331.441 4.340 20 5 EIBDMO CCSc1cc(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])ccn1 ZINC000893717303 1032835915 /nfs/dbraw/zinc/83/59/15/1032835915.db2.gz SZMGVZQUCIBDEP-UHFFFAOYSA-N 1 1 337.832 4.045 20 5 EIBDMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000120729401 1020107479 /nfs/dbraw/zinc/10/74/79/1020107479.db2.gz BMAZQIHIYWDVKD-CJNGLKHVSA-N 1 1 344.415 4.045 20 5 EIBDMO CC[C@@H](c1ccccc1)N(C)c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1 ZINC001167128341 1020294954 /nfs/dbraw/zinc/29/49/54/1020294954.db2.gz RVFMJRLPNXLCEG-FLVLSHQESA-N 1 1 340.427 4.110 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@@H](C)c1ccc(F)cc1 ZINC001167132125 1020309369 /nfs/dbraw/zinc/30/93/69/1020309369.db2.gz XNAGHOYQGBCAOE-ZDUSSCGKSA-N 1 1 332.375 4.326 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](C2CC2)C2CCCC2)c(Br)c1 ZINC001167363498 1021732346 /nfs/dbraw/zinc/73/23/46/1021732346.db2.gz AJTAOQHPOPUOIH-UHFFFAOYSA-N 1 1 339.233 4.264 20 5 EIBDMO CC[C@@H]1CCCCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000580604607 1021806751 /nfs/dbraw/zinc/80/67/51/1021806751.db2.gz LRVXCNIESYCVFH-MRXNPFEDSA-N 1 1 343.427 4.447 20 5 EIBDMO Cc1c([C@@H](C)[NH2+][C@H](C)c2nc3c(s2)CCC3)cccc1[N+](=O)[O-] ZINC000414133603 1021913451 /nfs/dbraw/zinc/91/34/51/1021913451.db2.gz AOQUNCBULIWIOB-VXGBXAGGSA-N 1 1 331.441 4.260 20 5 EIBDMO CC[C@@H]([NH2+]Cc1ccc(Br)o1)c1cccc([N+](=O)[O-])c1 ZINC000188729518 1022772948 /nfs/dbraw/zinc/77/29/48/1022772948.db2.gz KHXCVLQFVMOQPG-CYBMUJFWSA-N 1 1 339.189 4.191 20 5 EIBDMO CCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1C[C@@H](OCC)C1(C)C ZINC001167443291 1022808079 /nfs/dbraw/zinc/80/80/79/1022808079.db2.gz RMDQIBORKPLOPS-QZTJIDSGSA-N 1 1 334.460 4.053 20 5 EIBDMO Cc1cc(NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000311184016 1022924463 /nfs/dbraw/zinc/92/44/63/1022924463.db2.gz BEPNMHOTBOCMJL-GOSISDBHSA-N 1 1 339.439 4.227 20 5 EIBDMO C[C@@H]1[C@@H](c2ccccc2)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000177551864 1022973328 /nfs/dbraw/zinc/97/33/28/1022973328.db2.gz FZWOCFFNQUYMSO-CJNGLKHVSA-N 1 1 337.379 4.114 20 5 EIBDMO C[C@@H]([NH2+]Cc1cnc(CC(F)(F)F)s1)c1ccccc1[N+](=O)[O-] ZINC000893278171 1023045346 /nfs/dbraw/zinc/04/53/46/1023045346.db2.gz BBPVIRWAKSGJBU-SECBINFHSA-N 1 1 345.346 4.007 20 5 EIBDMO CCc1cnc(C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)s1 ZINC000417314568 1023260081 /nfs/dbraw/zinc/26/00/81/1023260081.db2.gz RJYUCXAHGNVGET-INIZCTEOSA-N 1 1 331.441 4.171 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1cnc(C3CC3)o1)CCCC2 ZINC000417324550 1023265547 /nfs/dbraw/zinc/26/55/47/1023265547.db2.gz AKEZZDINIWHLGC-KRWDZBQOSA-N 1 1 327.384 4.018 20 5 EIBDMO CC[C@H](C)[C@H](C)[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000566519259 1023446080 /nfs/dbraw/zinc/44/60/80/1023446080.db2.gz IENNQEDZMBTLPV-ZFWWWQNUSA-N 1 1 347.459 4.131 20 5 EIBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000051132322 1023467996 /nfs/dbraw/zinc/46/79/96/1023467996.db2.gz XZLPSWRFGQBTNM-UYAOXDASSA-N 1 1 340.423 4.195 20 5 EIBDMO COCCCC[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000418134795 1023551439 /nfs/dbraw/zinc/55/14/39/1023551439.db2.gz ODLKVAYPFIDGTN-UHFFFAOYSA-N 1 1 334.441 4.182 20 5 EIBDMO C[C@@]1([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCOc2ccccc21 ZINC000933371890 1023598673 /nfs/dbraw/zinc/59/86/73/1023598673.db2.gz SYAIIGKRUCWEGR-QGZVFWFLSA-N 1 1 332.787 4.036 20 5 EIBDMO COc1ccc(CCC[N@@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000108722227 1024074620 /nfs/dbraw/zinc/07/46/20/1024074620.db2.gz KELRKEYZKGPRBV-OAHLLOKOSA-N 1 1 328.412 4.229 20 5 EIBDMO C[C@H]([NH2+]Cc1ccsc1Br)c1cccc([N+](=O)[O-])c1 ZINC000388566566 1024861947 /nfs/dbraw/zinc/86/19/47/1024861947.db2.gz VGAIZPMITVIOJV-VIFPVBQESA-N 1 1 341.230 4.270 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccsc1Br)c1cccc([N+](=O)[O-])c1 ZINC000388566564 1024862936 /nfs/dbraw/zinc/86/29/36/1024862936.db2.gz VGAIZPMITVIOJV-SECBINFHSA-N 1 1 341.230 4.270 20 5 EIBDMO CCc1ccc([C@@H](COC)[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)o1 ZINC000165260821 1025174988 /nfs/dbraw/zinc/17/49/88/1025174988.db2.gz UUDDCRDPKDRPQK-SUMWQHHRSA-N 1 1 332.400 4.097 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(c3ccncc3)CC2)ccc1Cl ZINC000277166729 1025178764 /nfs/dbraw/zinc/17/87/64/1025178764.db2.gz KNGYMAPVCLIGFF-UHFFFAOYSA-N 1 1 331.803 4.023 20 5 EIBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH+]1CCC(F)(c2cccnc2)CC1 ZINC000342144903 1025341128 /nfs/dbraw/zinc/34/11/28/1025341128.db2.gz CJLPIMBWSBJJSK-UHFFFAOYSA-N 1 1 349.793 4.104 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(F)(c3cccnc3)CC2)c(Cl)c1 ZINC000342147746 1025347119 /nfs/dbraw/zinc/34/71/19/1025347119.db2.gz FWIXCCKACYJKFP-UHFFFAOYSA-N 1 1 349.793 4.104 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccc(OC(F)F)cc1 ZINC000302737758 1025645956 /nfs/dbraw/zinc/64/59/56/1025645956.db2.gz GJNJHHREUJLULI-LBPRGKRZSA-N 1 1 336.338 4.389 20 5 EIBDMO O=[N+]([O-])c1ccc(CC[N@@H+](Cc2ccco2)Cc2cccs2)cc1 ZINC000071952255 1025855984 /nfs/dbraw/zinc/85/59/84/1025855984.db2.gz NJJJOJYAPMWIJO-UHFFFAOYSA-N 1 1 342.420 4.494 20 5 EIBDMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC001167543909 1026040749 /nfs/dbraw/zinc/04/07/49/1026040749.db2.gz GOHSMZKVJJCTDI-AWEZNQCLSA-N 1 1 341.249 4.368 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](c1ncccc1C)C(C)(C)C ZINC000934288837 1026155199 /nfs/dbraw/zinc/15/51/99/1026155199.db2.gz ZHGONZQHSCXCMF-SFHVURJKSA-N 1 1 343.427 4.184 20 5 EIBDMO C[C@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1nccn1-c1ccccc1 ZINC000582370692 1026499539 /nfs/dbraw/zinc/49/95/39/1026499539.db2.gz XKRIJRGNEWWYMX-KBXCAEBGSA-N 1 1 348.406 4.119 20 5 EIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC1CCC(C(F)(F)F)CC1 ZINC000511127951 1026646790 /nfs/dbraw/zinc/64/67/90/1026646790.db2.gz YJXYFRYRIWKJHG-UHFFFAOYSA-N 1 1 344.377 4.438 20 5 EIBDMO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000611554146 1027009842 /nfs/dbraw/zinc/00/98/42/1027009842.db2.gz GDKVGHJYGUSMTG-STQMWFEESA-N 1 1 346.349 4.027 20 5 EIBDMO C[C@@H](Nc1ccc([N+](=O)[O-])cc1F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310795438 1027405007 /nfs/dbraw/zinc/40/50/07/1027405007.db2.gz FMJFBTAOYQTWLC-ZBFHGGJFSA-N 1 1 343.402 4.056 20 5 EIBDMO C[C@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000441335333 1027451529 /nfs/dbraw/zinc/45/15/29/1027451529.db2.gz FOADINQQQMURIR-SGTLLEGYSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000441335333 1027451542 /nfs/dbraw/zinc/45/15/42/1027451542.db2.gz FOADINQQQMURIR-SGTLLEGYSA-N 1 1 332.350 4.456 20 5 EIBDMO COc1ccccc1C[C@H](C)[N@@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000441414662 1027536070 /nfs/dbraw/zinc/53/60/70/1027536070.db2.gz KLKOCZBFQMTZAV-ZDUSSCGKSA-N 1 1 348.830 4.320 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](c3nccs3)C2)ccc1Cl ZINC000153653434 1027830253 /nfs/dbraw/zinc/83/02/53/1027830253.db2.gz GSPVUBZDLDFFHT-LBPRGKRZSA-N 1 1 337.832 4.084 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](c3nccs3)C2)ccc1Cl ZINC000153653434 1027830262 /nfs/dbraw/zinc/83/02/62/1027830262.db2.gz GSPVUBZDLDFFHT-LBPRGKRZSA-N 1 1 337.832 4.084 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](CCSc1ccc(Cl)cc1)CC2 ZINC001167646404 1027830583 /nfs/dbraw/zinc/83/05/83/1027830583.db2.gz BTOQJGFKXLZOKL-UHFFFAOYSA-N 1 1 348.855 4.399 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](CCSc1ccc(Cl)cc1)CC2 ZINC001167646404 1027830589 /nfs/dbraw/zinc/83/05/89/1027830589.db2.gz BTOQJGFKXLZOKL-UHFFFAOYSA-N 1 1 348.855 4.399 20 5 EIBDMO C[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000444661628 1027931024 /nfs/dbraw/zinc/93/10/24/1027931024.db2.gz IDZKVAFETDMAGP-GUYCJALGSA-N 1 1 329.400 4.260 20 5 EIBDMO CC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H]1CCCC[C@@H]1C ZINC000444674945 1027957688 /nfs/dbraw/zinc/95/76/88/1027957688.db2.gz KZNCXFNLAAKULX-XJKSGUPXSA-N 1 1 344.415 4.045 20 5 EIBDMO CC[N@H+](Cc1ccc(OC)cc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000522536432 1027998918 /nfs/dbraw/zinc/99/89/18/1027998918.db2.gz QGORJVRJJRDBHW-UHFFFAOYSA-N 1 1 334.803 4.279 20 5 EIBDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000522536432 1027998929 /nfs/dbraw/zinc/99/89/29/1027998929.db2.gz QGORJVRJJRDBHW-UHFFFAOYSA-N 1 1 334.803 4.279 20 5 EIBDMO CCC[N@@H+](CC)Cc1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000508514274 1028226412 /nfs/dbraw/zinc/22/64/12/1028226412.db2.gz VQEAWBHVIRHEEJ-UHFFFAOYSA-N 1 1 341.411 4.079 20 5 EIBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1cccc(OC)c1 ZINC000523702140 1028325592 /nfs/dbraw/zinc/32/55/92/1028325592.db2.gz XMZOOZKGFFIVLY-HNNXBMFYSA-N 1 1 328.412 4.229 20 5 EIBDMO COc1ccccc1[C@@H]1CC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000524252170 1028815020 /nfs/dbraw/zinc/81/50/20/1028815020.db2.gz DHIYEDBSZKHACB-CYBMUJFWSA-N 1 1 346.814 4.246 20 5 EIBDMO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1nccn1-c1ccccc1 ZINC000346948528 1028827380 /nfs/dbraw/zinc/82/73/80/1028827380.db2.gz QFZCHXSLWGBTML-GJZGRUSLSA-N 1 1 336.395 4.192 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000248669095 1029133945 /nfs/dbraw/zinc/13/39/45/1029133945.db2.gz AMRLLNXEWUFIGY-QRWLVFNGSA-N 1 1 338.407 4.096 20 5 EIBDMO Cc1c(C[N@@H+]2CCC[C@@H]2c2cccc(N(C)C)c2)cccc1[N+](=O)[O-] ZINC000524755988 1029205462 /nfs/dbraw/zinc/20/54/62/1029205462.db2.gz FLOBTYSKUANYRX-HXUWFJFHSA-N 1 1 339.439 4.306 20 5 EIBDMO COCC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@@H](C)c1ccccc1 ZINC000508560001 1029266776 /nfs/dbraw/zinc/26/67/76/1029266776.db2.gz HOMRYSRUGHCWAR-INIZCTEOSA-N 1 1 328.412 4.113 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](C(F)(F)F)[C@H]1C ZINC000475281501 1029495579 /nfs/dbraw/zinc/49/55/79/1029495579.db2.gz PNBGXSSKBMLFIJ-SEOWSWFZSA-N 1 1 328.334 4.271 20 5 EIBDMO CC(C)c1ccc(C[N@H+]2CC[C@H](CC(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000446974783 1029655574 /nfs/dbraw/zinc/65/55/74/1029655574.db2.gz LTENSNQEQGBUKW-CYBMUJFWSA-N 1 1 330.350 4.493 20 5 EIBDMO COc1cc(C[NH2+][C@@H](C)c2ccc(F)cc2Cl)ccc1[N+](=O)[O-] ZINC000451110745 1030237281 /nfs/dbraw/zinc/23/72/81/1030237281.db2.gz YUUNJWFOACONTM-JTQLQIEISA-N 1 1 338.766 4.247 20 5 EIBDMO COc1cc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)ccc1C ZINC000447797902 1030331005 /nfs/dbraw/zinc/33/10/05/1030331005.db2.gz OYAJNVYMAULSQC-UHFFFAOYSA-N 1 1 326.396 4.076 20 5 EIBDMO COc1cc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)ccc1C ZINC000447797902 1030331024 /nfs/dbraw/zinc/33/10/24/1030331024.db2.gz OYAJNVYMAULSQC-UHFFFAOYSA-N 1 1 326.396 4.076 20 5 EIBDMO Cc1nc(C(C)C)oc1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451553101 1030572827 /nfs/dbraw/zinc/57/28/27/1030572827.db2.gz XHLPCJCHFMVATJ-INIZCTEOSA-N 1 1 343.427 4.394 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@@H]2CCC2CCCCC2)cc1 ZINC001168174912 1030664501 /nfs/dbraw/zinc/66/45/01/1030664501.db2.gz JXDWLAPBXKLFOY-QUCCMNQESA-N 1 1 346.471 4.453 20 5 EIBDMO COc1ccc(C[N@@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)cc1[N+](=O)[O-] ZINC000191664517 1031097253 /nfs/dbraw/zinc/09/72/53/1031097253.db2.gz APTKQIOHLDEMFU-CQSZACIVSA-N 1 1 346.349 4.014 20 5 EIBDMO COc1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)C(C)(C)C2)cc1[N+](=O)[O-] ZINC000191664517 1031097266 /nfs/dbraw/zinc/09/72/66/1031097266.db2.gz APTKQIOHLDEMFU-CQSZACIVSA-N 1 1 346.349 4.014 20 5 EIBDMO C[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1cccc(OC(F)F)c1 ZINC000179591280 1031220652 /nfs/dbraw/zinc/22/06/52/1031220652.db2.gz MATYBSNEPOWRNT-JTQLQIEISA-N 1 1 340.301 4.186 20 5 EIBDMO O=[N+]([O-])c1cccc(C[NH2+][C@@H]2CCCc3cn(C4CCCC4)nc32)c1 ZINC000375832791 1031321432 /nfs/dbraw/zinc/32/14/32/1031321432.db2.gz QXEZEJHIBBYNEX-GOSISDBHSA-N 1 1 340.427 4.074 20 5 EIBDMO CCc1ccc([C@@H]([NH2+]CCC(C)(F)F)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453227255 1031744917 /nfs/dbraw/zinc/74/49/17/1031744917.db2.gz YEHRMHSHUFTBSH-INIZCTEOSA-N 1 1 338.354 4.475 20 5 EIBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@H]1C ZINC000449505625 1031815222 /nfs/dbraw/zinc/81/52/22/1031815222.db2.gz RIDOPOUFCBCPDI-DYVFJYSZSA-N 1 1 346.452 4.180 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](c1cccnc1)C1CC1 ZINC000347374673 1031976327 /nfs/dbraw/zinc/97/63/27/1031976327.db2.gz XGADJDAUZQDUKX-IBGZPJMESA-N 1 1 341.411 4.018 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+]Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000182341427 1034803455 /nfs/dbraw/zinc/80/34/55/1034803455.db2.gz ZMTNEZQDURDJLA-AWEZNQCLSA-N 1 1 337.379 4.409 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3ncccc3F)s2)cc1 ZINC000126307467 1034978400 /nfs/dbraw/zinc/97/84/00/1034978400.db2.gz CMCPAJAMYWJBMZ-UHFFFAOYSA-N 1 1 343.383 4.147 20 5 EIBDMO C[C@H](NCc1ccc(C[NH+]2CCCC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000182818018 1034996686 /nfs/dbraw/zinc/99/66/86/1034996686.db2.gz VMULRQJLHBTDEW-INIZCTEOSA-N 1 1 339.439 4.041 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccncc1F ZINC000509935011 1035015715 /nfs/dbraw/zinc/01/57/15/1035015715.db2.gz QMGBWMPJYHRHFY-GFCCVEGCSA-N 1 1 341.342 4.240 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](C)c1cccc(F)c1F ZINC000595035743 1035561491 /nfs/dbraw/zinc/56/14/91/1035561491.db2.gz LXQBHSBXRRHCEX-MNOVXSKESA-N 1 1 336.338 4.293 20 5 EIBDMO COc1ccc(C[N@@H+](C)Cc2csc3ccccc23)cc1[N+](=O)[O-] ZINC000502010342 1035805694 /nfs/dbraw/zinc/80/56/94/1035805694.db2.gz RJOKKIBQJLDSJU-UHFFFAOYSA-N 1 1 342.420 4.450 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000485797555 1036279213 /nfs/dbraw/zinc/27/92/13/1036279213.db2.gz YMNKDWQRDMYLLR-HNAYVOBHSA-N 1 1 326.396 4.038 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000485797555 1036279235 /nfs/dbraw/zinc/27/92/35/1036279235.db2.gz YMNKDWQRDMYLLR-HNAYVOBHSA-N 1 1 326.396 4.038 20 5 EIBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCC1(F)F ZINC000588232576 1036306456 /nfs/dbraw/zinc/30/64/56/1036306456.db2.gz OLIGMEQGVKCERD-SMDDNHRTSA-N 1 1 330.400 4.243 20 5 EIBDMO CCOc1ccc(C[N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000761240273 1036357160 /nfs/dbraw/zinc/35/71/60/1036357160.db2.gz VUUKFBAFBWFEKZ-UHFFFAOYSA-N 1 1 334.803 4.279 20 5 EIBDMO CC[C@@H]1C[C@]1([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1cccc(C)c1 ZINC000502564758 1036358239 /nfs/dbraw/zinc/35/82/39/1036358239.db2.gz ILMPNHKVLIXCGC-AUUYWEPGSA-N 1 1 328.387 4.457 20 5 EIBDMO CC1(C)C[C@@]1([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 ZINC000602715850 1036588133 /nfs/dbraw/zinc/58/81/33/1036588133.db2.gz PFWHXGYUDBURPM-LJQANCHMSA-N 1 1 337.379 4.151 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000589200210 1036708571 /nfs/dbraw/zinc/70/85/71/1036708571.db2.gz WJKXSVIJKNQLJS-WFNWROLRSA-N 1 1 344.455 4.137 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H](c2ccccn2)C2CCC2)c(Cl)c1 ZINC000598994213 1036846166 /nfs/dbraw/zinc/84/61/66/1036846166.db2.gz ZADFIAGBBSEOFY-QGZVFWFLSA-N 1 1 331.803 4.274 20 5 EIBDMO COc1cc(C[N@@H+](C)[C@H](C)C(C)(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000603553587 1036882045 /nfs/dbraw/zinc/88/20/45/1036882045.db2.gz DNSALSMXEBDDHB-SNVBAGLBSA-N 1 1 346.374 4.071 20 5 EIBDMO COCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CCCC1 ZINC000590155850 1036994579 /nfs/dbraw/zinc/99/45/79/1036994579.db2.gz KFWKNWVKRTVTGI-UHFFFAOYSA-N 1 1 346.349 4.005 20 5 EIBDMO Cc1c(C[N@@H+](C)CCOc2ccccc2Cl)cccc1[N+](=O)[O-] ZINC000603836984 1037031644 /nfs/dbraw/zinc/03/16/44/1037031644.db2.gz OVCUDWUCOOVVFT-UHFFFAOYSA-N 1 1 334.803 4.067 20 5 EIBDMO COCC[N@@H+](Cc1ccc(C)cc1C)Cc1cccc([N+](=O)[O-])c1C ZINC000603895188 1037070876 /nfs/dbraw/zinc/07/08/76/1037070876.db2.gz VWSAJHUYCJWRBA-UHFFFAOYSA-N 1 1 342.439 4.169 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H](C)C2CC2)cc1 ZINC000057601367 1037136490 /nfs/dbraw/zinc/13/64/90/1037136490.db2.gz QBLKTGOPBQYOKA-HNNXBMFYSA-N 1 1 340.423 4.404 20 5 EIBDMO C[C@@H](N[C@H]1CCC[NH2+]CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000591578332 1037505490 /nfs/dbraw/zinc/50/54/90/1037505490.db2.gz RGEGGTAHJCQEHT-KGLIPLIRSA-N 1 1 345.468 4.116 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)C[C@H]1OCCc2ccccc21 ZINC000489150027 1037882736 /nfs/dbraw/zinc/88/27/36/1037882736.db2.gz AJPDUKOAJQBGSI-FOIQADDNSA-N 1 1 340.423 4.210 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000490017009 1038315051 /nfs/dbraw/zinc/31/50/51/1038315051.db2.gz XESOBGCVZMUMIK-CRAIPNDOSA-N 1 1 325.412 4.232 20 5 EIBDMO C[C@@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)c1ccccc1[N+](=O)[O-] ZINC000504416515 1038359665 /nfs/dbraw/zinc/35/96/65/1038359665.db2.gz QGXRBZYMCGBTNI-CYBMUJFWSA-N 1 1 329.400 4.018 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](CSc3ccccc3)C2)c(F)c1 ZINC000490377714 1038609875 /nfs/dbraw/zinc/60/98/75/1038609875.db2.gz XLGXYNKKJLGLOC-CQSZACIVSA-N 1 1 346.427 4.348 20 5 EIBDMO CN(C)c1cccc([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC000490405160 1038629144 /nfs/dbraw/zinc/62/91/44/1038629144.db2.gz WANIAHCBYWDZJX-LJQANCHMSA-N 1 1 343.402 4.137 20 5 EIBDMO Cc1cccc(NC2CC[NH+](Cc3ccc([N+](=O)[O-])cc3F)CC2)c1 ZINC000490429450 1038629242 /nfs/dbraw/zinc/62/92/42/1038629242.db2.gz FSOFHTXJQOQRFC-UHFFFAOYSA-N 1 1 343.402 4.119 20 5 EIBDMO CC[C@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1cccc([N+](=O)[O-])c1 ZINC000539063003 1038807237 /nfs/dbraw/zinc/80/72/37/1038807237.db2.gz NPKIJPKWRPEXQK-HOTGVXAUSA-N 1 1 332.787 4.423 20 5 EIBDMO 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ZINC000481707047 1039760940 /nfs/dbraw/zinc/76/09/40/1039760940.db2.gz MLEHOYKOORONNB-YWZLYKJASA-N 1 1 338.407 4.177 20 5 EIBDMO CCc1nc(C)c([C@H](C)[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)s1 ZINC000122165918 1040330416 /nfs/dbraw/zinc/33/04/16/1040330416.db2.gz OTKRDRQEIMFYED-ZDUSSCGKSA-N 1 1 333.457 4.158 20 5 EIBDMO C[C@H]1CCC[C@H]([N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000535562443 1040361713 /nfs/dbraw/zinc/36/17/13/1040361713.db2.gz XPEVXYQZNGANLT-GUYCJALGSA-N 1 1 329.400 4.260 20 5 EIBDMO C[N@@H+](Cc1ccc(OC(F)(F)F)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000479834257 1040691746 /nfs/dbraw/zinc/69/17/46/1040691746.db2.gz VRTWJBCTUVGWCY-UHFFFAOYSA-N 1 1 340.301 4.125 20 5 EIBDMO CC(C)CO[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000537724983 1040775878 /nfs/dbraw/zinc/77/58/78/1040775878.db2.gz JLNFUKFGNWAOMX-KRWDZBQOSA-N 1 1 344.411 4.102 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCO[C@H](c2ccccc2C)C1 ZINC000539808794 1040804921 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COc1cc(C[N@@H+](C)[C@@H](C)c2ccc(F)cc2)c([N+](=O)[O-])cc1F ZINC000463469489 1041587551 /nfs/dbraw/zinc/58/75/51/1041587551.db2.gz KYKMFHIZIRCVSE-NSHDSACASA-N 1 1 336.338 4.075 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(N[C@H](Cc2[nH+]ccn2C)c2ccccc2)c1 ZINC000088726384 1041699640 /nfs/dbraw/zinc/69/96/40/1041699640.db2.gz KPISJEZKKVSUPO-MRXNPFEDSA-N 1 1 336.395 4.033 20 5 EIBDMO CCC[C@H]([NH2+][C@H](c1ccccc1F)[C@H](C)O)c1cccc([N+](=O)[O-])c1 ZINC000517035862 1041844943 /nfs/dbraw/zinc/84/49/43/1041844943.db2.gz RJYOVNOQTVDPRV-AGRHKRQWSA-N 1 1 346.402 4.287 20 5 EIBDMO COc1cccc(C2=CC[N@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000437592630 1041846648 /nfs/dbraw/zinc/84/66/48/1041846648.db2.gz LZNHSZLPYLPWFF-HNNXBMFYSA-N 1 1 338.407 4.454 20 5 EIBDMO C[N@@H+](CCc1ccc(Br)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000517379434 1041984244 /nfs/dbraw/zinc/98/42/44/1041984244.db2.gz DFGPVPNRNMVVRO-UHFFFAOYSA-N 1 1 349.228 4.032 20 5 EIBDMO COc1cccc(F)c1[C@H](C)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000122461190 1042085334 /nfs/dbraw/zinc/08/53/34/1042085334.db2.gz VYLXXKLWSJYBGM-OLZOCXBDSA-N 1 1 332.375 4.463 20 5 EIBDMO CC[NH+](CC)Cc1ccccc1CN[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000073520850 1042211523 /nfs/dbraw/zinc/21/15/23/1042211523.db2.gz CEQDPRPYZUGSFF-INIZCTEOSA-N 1 1 341.455 4.287 20 5 EIBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH+]1CCC(c2ccncc2)CC1 ZINC000429601911 1042362425 /nfs/dbraw/zinc/36/24/25/1042362425.db2.gz XEJONBYQKCGETM-UHFFFAOYSA-N 1 1 331.803 4.023 20 5 EIBDMO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000271821864 1042411485 /nfs/dbraw/zinc/41/14/85/1042411485.db2.gz SHPWHZJOTXZWNG-CHWSQXEVSA-N 1 1 330.432 4.267 20 5 EIBDMO COc1ccc(-c2ccc(C[NH2+]Cc3occc3C)o2)c([N+](=O)[O-])c1 ZINC000491436152 1042447453 /nfs/dbraw/zinc/44/74/53/1042447453.db2.gz WHABQPJGNBANRW-UHFFFAOYSA-N 1 1 342.351 4.055 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000491435439 1042447502 /nfs/dbraw/zinc/44/75/02/1042447502.db2.gz URRJZLHJWKBSAP-VCBZYWHSSA-N 1 1 326.396 4.118 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000491435439 1042447505 /nfs/dbraw/zinc/44/75/05/1042447505.db2.gz URRJZLHJWKBSAP-VCBZYWHSSA-N 1 1 326.396 4.118 20 5 EIBDMO CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@@H](C)c1cccc(OC)c1 ZINC000518474147 1042539659 /nfs/dbraw/zinc/53/96/59/1042539659.db2.gz NRPDXSZCKNWDTH-HNNXBMFYSA-N 1 1 344.411 4.065 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCCOCc1ccccc1 ZINC000439474086 1042645022 /nfs/dbraw/zinc/64/50/22/1042645022.db2.gz MYBKBXCWDQKEQU-MRXNPFEDSA-N 1 1 328.412 4.195 20 5 EIBDMO COc1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)cc1F ZINC000761504904 1042873608 /nfs/dbraw/zinc/87/36/08/1042873608.db2.gz AEXRYDMMPWOHMY-UHFFFAOYSA-N 1 1 338.766 4.028 20 5 EIBDMO COc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)cc1F ZINC000761504904 1042873610 /nfs/dbraw/zinc/87/36/10/1042873610.db2.gz AEXRYDMMPWOHMY-UHFFFAOYSA-N 1 1 338.766 4.028 20 5 EIBDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761506029 1042874022 /nfs/dbraw/zinc/87/40/22/1042874022.db2.gz MKWUGNFMBQGVNE-UHFFFAOYSA-N 1 1 334.803 4.279 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCC(F)(F)F)CC2CC2)cc1Cl ZINC000761513585 1042874438 /nfs/dbraw/zinc/87/44/38/1042874438.db2.gz ATQLZKKJNUKGJF-UHFFFAOYSA-N 1 1 336.741 4.413 20 5 EIBDMO O=[N+]([O-])c1cc(F)ccc1NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000493383342 1042902888 /nfs/dbraw/zinc/90/28/88/1042902888.db2.gz HFYIMFSLIGWJPT-ZDUSSCGKSA-N 1 1 349.431 4.120 20 5 EIBDMO CC[N@H+](Cc1cccc(Br)c1)Cc1ccccc1[N+](=O)[O-] ZINC000521220970 1043655449 /nfs/dbraw/zinc/65/54/49/1043655449.db2.gz ZWRMDOYJQIDBIT-UHFFFAOYSA-N 1 1 349.228 4.379 20 5 EIBDMO CC[N@@H+](Cc1cccc(Br)c1)Cc1ccccc1[N+](=O)[O-] ZINC000521220970 1043655461 /nfs/dbraw/zinc/65/54/61/1043655461.db2.gz ZWRMDOYJQIDBIT-UHFFFAOYSA-N 1 1 349.228 4.379 20 5 EIBDMO Cc1c(C[N@@H+]2[C@H](C)CO[C@H](c3ccccc3)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000731892662 1043840761 /nfs/dbraw/zinc/84/07/61/1043840761.db2.gz JGBHDSBDQFBTPI-IIMJZQEZSA-N 1 1 340.423 4.254 20 5 EIBDMO Cc1c(C[N@H+]2[C@H](C)CO[C@H](c3ccccc3)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000731892662 1043840763 /nfs/dbraw/zinc/84/07/63/1043840763.db2.gz JGBHDSBDQFBTPI-IIMJZQEZSA-N 1 1 340.423 4.254 20 5 EIBDMO Cc1ccccc1C[C@@H]1CCC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000734149679 1044495418 /nfs/dbraw/zinc/49/54/18/1044495418.db2.gz FMWWTZPYHXXMBG-SFHVURJKSA-N 1 1 328.387 4.249 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC000734836380 1044695983 /nfs/dbraw/zinc/69/59/83/1044695983.db2.gz CUTAHDIRUXOXGI-CYBMUJFWSA-N 1 1 334.778 4.377 20 5 EIBDMO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1ccc([N+](=O)[O-])cc1 ZINC000154642473 1044821349 /nfs/dbraw/zinc/82/13/49/1044821349.db2.gz AAFSEUMQDQGXGA-QRWLVFNGSA-N 1 1 333.391 4.430 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H](c2ccccn2)C2CC2)o1 ZINC000922585879 1044830880 /nfs/dbraw/zinc/83/08/80/1044830880.db2.gz HWNAIMYPTYHLKL-FQEVSTJZSA-N 1 1 349.390 4.491 20 5 EIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000735495501 1044831994 /nfs/dbraw/zinc/83/19/94/1044831994.db2.gz XWOIHWYZOQQEED-QGZVFWFLSA-N 1 1 332.400 4.024 20 5 EIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000735495501 1044832000 /nfs/dbraw/zinc/83/20/00/1044832000.db2.gz XWOIHWYZOQQEED-QGZVFWFLSA-N 1 1 332.400 4.024 20 5 EIBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)[C@H]1CCc2ccccc2C1 ZINC000735493240 1044832628 /nfs/dbraw/zinc/83/26/28/1044832628.db2.gz NPFYWAZFRUDICN-INIZCTEOSA-N 1 1 330.815 4.238 20 5 EIBDMO CCCCOc1ncccc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000154751104 1044833445 /nfs/dbraw/zinc/83/34/45/1044833445.db2.gz CMGRTLNOZUGHNK-OAHLLOKOSA-N 1 1 343.427 4.328 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC4(CCC4)C3)cs2)c1 ZINC000093455779 1044836781 /nfs/dbraw/zinc/83/67/81/1044836781.db2.gz WGDHTVKAYIUUGO-UHFFFAOYSA-N 1 1 329.425 4.094 20 5 EIBDMO CN(C)c1cccc([C@@H]2CCC[N@H+]2Cc2cc(F)ccc2[N+](=O)[O-])c1 ZINC000735875162 1044871765 /nfs/dbraw/zinc/87/17/65/1044871765.db2.gz ZTUWBWSHVDMMOZ-SFHVURJKSA-N 1 1 343.402 4.137 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCCC[C@H]1c1ccncc1 ZINC000543626495 1044974576 /nfs/dbraw/zinc/97/45/76/1044974576.db2.gz CVCVLOAKSCUTIV-IBGZPJMESA-N 1 1 325.412 4.416 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC000125502282 1045006649 /nfs/dbraw/zinc/00/66/49/1045006649.db2.gz OJSLFYJMBIXINS-GOSISDBHSA-N 1 1 341.411 4.114 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000125502282 1045006665 /nfs/dbraw/zinc/00/66/65/1045006665.db2.gz OJSLFYJMBIXINS-GOSISDBHSA-N 1 1 341.411 4.114 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2CCCc3cccnc32)o1 ZINC000922879405 1045016933 /nfs/dbraw/zinc/01/69/33/1045016933.db2.gz JEVBXDCXLHFHGE-QGZVFWFLSA-N 1 1 349.390 4.417 20 5 EIBDMO COc1ccccc1[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000738340711 1045051427 /nfs/dbraw/zinc/05/14/27/1045051427.db2.gz ONSSJEUDFOZEQF-CYBMUJFWSA-N 1 1 346.814 4.246 20 5 EIBDMO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC001168741453 1045233745 /nfs/dbraw/zinc/23/37/45/1045233745.db2.gz KTUMBOPUFYDFGZ-MRXNPFEDSA-N 1 1 349.774 4.397 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](C[C@H]2CCOc3ccccc32)C2CC2)c1 ZINC000611254778 1045267126 /nfs/dbraw/zinc/26/71/26/1045267126.db2.gz UIMNRMUQQNXKOO-MRXNPFEDSA-N 1 1 338.407 4.126 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCCC[C@H]3c3ccccc3)nc2c1 ZINC000762631771 1045320370 /nfs/dbraw/zinc/32/03/70/1045320370.db2.gz GEKNQROYFOXEKW-KRWDZBQOSA-N 1 1 337.379 4.463 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCCC[C@H]3c3ccccc3)nc2c1 ZINC000762631771 1045320376 /nfs/dbraw/zinc/32/03/76/1045320376.db2.gz GEKNQROYFOXEKW-KRWDZBQOSA-N 1 1 337.379 4.463 20 5 EIBDMO COc1ccc(C[N@@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1OC ZINC000611515138 1045320537 /nfs/dbraw/zinc/32/05/37/1045320537.db2.gz PRVKODXBHADGQL-CQSZACIVSA-N 1 1 344.411 4.113 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1cc(-c2ccccc2)n[nH]1 ZINC000768205949 1045742520 /nfs/dbraw/zinc/74/25/20/1045742520.db2.gz CIROISUHWQOCIX-AWEZNQCLSA-N 1 1 336.395 4.178 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1cc(-c2ccccc2)n[nH]1 ZINC000768205949 1045742531 /nfs/dbraw/zinc/74/25/31/1045742531.db2.gz CIROISUHWQOCIX-AWEZNQCLSA-N 1 1 336.395 4.178 20 5 EIBDMO CC(C)c1ccc(C[N@H+](C)Cc2ccc(Cl)nc2)cc1[N+](=O)[O-] ZINC000768238027 1045765610 /nfs/dbraw/zinc/76/56/10/1045765610.db2.gz USSVCSXIKSAACI-UHFFFAOYSA-N 1 1 333.819 4.399 20 5 EIBDMO CC(C)c1ccc(C[N@@H+](C)Cc2ccc(Cl)nc2)cc1[N+](=O)[O-] ZINC000768238027 1045765630 /nfs/dbraw/zinc/76/56/30/1045765630.db2.gz USSVCSXIKSAACI-UHFFFAOYSA-N 1 1 333.819 4.399 20 5 EIBDMO C[C@H]1CCC[N@@H+](CCCCNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000301116982 1045817836 /nfs/dbraw/zinc/81/78/36/1045817836.db2.gz URDZPBYOMMKASN-HNNXBMFYSA-N 1 1 342.443 4.067 20 5 EIBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000768548856 1045822460 /nfs/dbraw/zinc/82/24/60/1045822460.db2.gz ILAXJXXZGYKKJD-CHWSQXEVSA-N 1 1 328.865 4.354 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC(c2cccnc2)CC1 ZINC000768754817 1045837354 /nfs/dbraw/zinc/83/73/54/1045837354.db2.gz SCFXPAJZPUFVPP-UHFFFAOYSA-N 1 1 331.803 4.023 20 5 EIBDMO NC(=O)CC[C@@H]1CCC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000769187980 1045891337 /nfs/dbraw/zinc/89/13/37/1045891337.db2.gz DCYQWKXZPILQOS-KRWDZBQOSA-N 1 1 346.474 4.471 20 5 EIBDMO CNC(=O)CC[N@@H+](C)Cc1c2ccccc2c(Cl)c2ccccc21 ZINC000769316220 1045920873 /nfs/dbraw/zinc/92/08/73/1045920873.db2.gz MXBGCVZOBBSEBF-UHFFFAOYSA-N 1 1 340.854 4.214 20 5 EIBDMO CC[N@@H+](Cc1ccccc1F)[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170352850 1046007495 /nfs/dbraw/zinc/00/74/95/1046007495.db2.gz RUELHWXLLKFLSJ-CQSZACIVSA-N 1 1 346.402 4.196 20 5 EIBDMO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000152468555 1046064302 /nfs/dbraw/zinc/06/43/02/1046064302.db2.gz OSACKKDAZWMALD-HNNXBMFYSA-N 1 1 331.441 4.123 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H](C)Cc1ccsc1 ZINC000792880745 1046089788 /nfs/dbraw/zinc/08/97/88/1046089788.db2.gz UOBBWXXFUWQTAJ-GFCCVEGCSA-N 1 1 349.412 4.018 20 5 EIBDMO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000792877903 1046091343 /nfs/dbraw/zinc/09/13/43/1046091343.db2.gz WXPJNDASGPCUPQ-OAHLLOKOSA-N 1 1 349.774 4.397 20 5 EIBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)[C@@H](c1ccccc1)N(C)C ZINC000769930537 1046114303 /nfs/dbraw/zinc/11/43/03/1046114303.db2.gz LDXZCTXEBQBGAP-UGSOOPFHSA-N 1 1 347.846 4.029 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc1C ZINC001170424271 1046119653 /nfs/dbraw/zinc/11/96/53/1046119653.db2.gz LZNBSDCRFWLRRW-SFHVURJKSA-N 1 1 340.423 4.291 20 5 EIBDMO c1ccc2c(c1)cc1ccccc1c2C[N@H+]1CCO[C@@H]([C@@H]2CCCO2)C1 ZINC000770303694 1046176853 /nfs/dbraw/zinc/17/68/53/1046176853.db2.gz IPGGPHZVTKCETO-XZOQPEGZSA-N 1 1 347.458 4.373 20 5 EIBDMO CCOc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000916987345 1046527821 /nfs/dbraw/zinc/52/78/21/1046527821.db2.gz FPKXRTBFHDMVTH-SFHVURJKSA-N 1 1 344.386 4.470 20 5 EIBDMO CCOc1ccc([C@@H]2CCC[N@H+]2Cc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000916987345 1046527838 /nfs/dbraw/zinc/52/78/38/1046527838.db2.gz FPKXRTBFHDMVTH-SFHVURJKSA-N 1 1 344.386 4.470 20 5 EIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000536676554 1046660523 /nfs/dbraw/zinc/66/05/23/1046660523.db2.gz SEZQKLSYTZQROJ-KRZKXXONSA-N 1 1 330.428 4.032 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccc2ncccc2c1)C1CC1 ZINC000154309282 1046808981 /nfs/dbraw/zinc/80/89/81/1046808981.db2.gz SSXBWBCIHACIEL-UHFFFAOYSA-N 1 1 333.391 4.308 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccc2ncccc2c1)C1CC1 ZINC000154309282 1046808984 /nfs/dbraw/zinc/80/89/84/1046808984.db2.gz SSXBWBCIHACIEL-UHFFFAOYSA-N 1 1 333.391 4.308 20 5 EIBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000788463357 1047193797 /nfs/dbraw/zinc/19/37/97/1047193797.db2.gz STDCCJBQWUKIGC-WBMJQRKESA-N 1 1 331.803 4.226 20 5 EIBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000788463357 1047193802 /nfs/dbraw/zinc/19/38/02/1047193802.db2.gz STDCCJBQWUKIGC-WBMJQRKESA-N 1 1 331.803 4.226 20 5 EIBDMO C[C@H]1SCC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@H]1c1ccccc1 ZINC000788479877 1047198751 /nfs/dbraw/zinc/19/87/51/1047198751.db2.gz FLDVBHIPWLWRHT-FZKQIMNGSA-N 1 1 346.427 4.413 20 5 EIBDMO C[C@H]1SCC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@H]1c1ccccc1 ZINC000788479877 1047198765 /nfs/dbraw/zinc/19/87/65/1047198765.db2.gz FLDVBHIPWLWRHT-FZKQIMNGSA-N 1 1 346.427 4.413 20 5 EIBDMO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1Cl)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788665088 1047265553 /nfs/dbraw/zinc/26/55/53/1047265553.db2.gz MFHBSRVXOAQVFU-NXEZZACHSA-N 1 1 337.782 4.381 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+][C@H]2COCc3cccc(Cl)c32)cc1[N+](=O)[O-] ZINC000788667300 1047267642 /nfs/dbraw/zinc/26/76/42/1047267642.db2.gz UPRQAQXXWCTFRZ-LRDDRELGSA-N 1 1 346.814 4.479 20 5 EIBDMO COc1cccc2cc([C@H](C)[NH2+]Cc3ccccc3[N+](=O)[O-])oc21 ZINC000194619755 1047403852 /nfs/dbraw/zinc/40/38/52/1047403852.db2.gz QJQYNYWPWJUAMW-LBPRGKRZSA-N 1 1 326.352 4.200 20 5 EIBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH+]1CCC(OC2CCCC2)CC1 ZINC000163515259 1047583325 /nfs/dbraw/zinc/58/33/25/1047583325.db2.gz DZPUYJNVHKSUSJ-UHFFFAOYSA-N 1 1 338.835 4.172 20 5 EIBDMO CC(=O)Nc1cccc([C@@H](C)[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000194767496 1047694058 /nfs/dbraw/zinc/69/40/58/1047694058.db2.gz XAKDVSXVGXOORV-LLVKDONJSA-N 1 1 347.802 4.057 20 5 EIBDMO CCCO[C@H]1CCC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000556878467 1048084231 /nfs/dbraw/zinc/08/42/31/1048084231.db2.gz YZCMZRVYELNCOR-KRWDZBQOSA-N 1 1 334.460 4.499 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@@H](c1ccccc1)[C@H](O)c1ccccc1 ZINC000808788128 1048108418 /nfs/dbraw/zinc/10/84/18/1048108418.db2.gz HPKQWPHWOQPWJB-LEWJYISDSA-N 1 1 348.402 4.159 20 5 EIBDMO c1ccc2c(c1)cc1ccccc1c2C[N@H+]1CCO[C@@]2(CCCOC2)C1 ZINC000809687258 1048473706 /nfs/dbraw/zinc/47/37/06/1048473706.db2.gz WBHYISYOGMGTKR-QHCPKHFHSA-N 1 1 347.458 4.374 20 5 EIBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@@H+]1CC[C@H](c2ccco2)C1 ZINC000809946728 1048568966 /nfs/dbraw/zinc/56/89/66/1048568966.db2.gz KUGVWCRTQMHDME-JTQLQIEISA-N 1 1 341.194 4.484 20 5 EIBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+]1CC[C@H](c2ccco2)C1 ZINC000809946728 1048568985 /nfs/dbraw/zinc/56/89/85/1048568985.db2.gz KUGVWCRTQMHDME-JTQLQIEISA-N 1 1 341.194 4.484 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@]4(CC4(F)F)C3)o2)cc1 ZINC000846106476 1048822823 /nfs/dbraw/zinc/82/28/23/1048822823.db2.gz BQPCWQFQDBVLSS-QGZVFWFLSA-N 1 1 348.349 4.476 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccccc1)CC1CCOCC1 ZINC000609540743 1049149109 /nfs/dbraw/zinc/14/91/09/1049149109.db2.gz XZJHBFDLDWDXEP-UHFFFAOYSA-N 1 1 340.423 4.024 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)ccc1Cl ZINC001171319078 1049256291 /nfs/dbraw/zinc/25/62/91/1049256291.db2.gz GPAGXPLESKZQPT-LLVKDONJSA-N 1 1 336.741 4.413 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)ccc1Cl ZINC001171319078 1049256301 /nfs/dbraw/zinc/25/63/01/1049256301.db2.gz GPAGXPLESKZQPT-LLVKDONJSA-N 1 1 336.741 4.413 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC001171324524 1049285558 /nfs/dbraw/zinc/28/55/58/1049285558.db2.gz ZALOPAOTIVLTLC-SNVBAGLBSA-N 1 1 336.741 4.413 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC001171324524 1049285572 /nfs/dbraw/zinc/28/55/72/1049285572.db2.gz ZALOPAOTIVLTLC-SNVBAGLBSA-N 1 1 336.741 4.413 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000609916186 1049395858 /nfs/dbraw/zinc/39/58/58/1049395858.db2.gz DKVNTJKHNYSCQV-ZBFHGGJFSA-N 1 1 328.387 4.360 20 5 EIBDMO C[C@H]1C[C@@H](N(C)c2ccccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000609964761 1049421306 /nfs/dbraw/zinc/42/13/06/1049421306.db2.gz CRZSZTJZKADTMR-WMZOPIPTSA-N 1 1 339.439 4.084 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000773037439 1049542345 /nfs/dbraw/zinc/54/23/45/1049542345.db2.gz VDCMDCUQPOCZTJ-LLVKDONJSA-N 1 1 349.774 4.316 20 5 EIBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccnc(Cl)c1 ZINC000773040114 1049548230 /nfs/dbraw/zinc/54/82/30/1049548230.db2.gz JOUPUZREHMSRHH-SECBINFHSA-N 1 1 326.183 4.147 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)[C@H](C)[C@H](O)c1ccccc1 ZINC000812849770 1049610463 /nfs/dbraw/zinc/61/04/63/1049610463.db2.gz JEEYNBKZLMOOTF-ACJLOTCBSA-N 1 1 348.830 4.192 20 5 EIBDMO Cc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC2CC2)cn1 ZINC001171502057 1049739686 /nfs/dbraw/zinc/73/96/86/1049739686.db2.gz PVXCARDXKYFJSO-UHFFFAOYSA-N 1 1 345.830 4.364 20 5 EIBDMO Cc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC2CC2)cn1 ZINC001171502057 1049739696 /nfs/dbraw/zinc/73/96/96/1049739696.db2.gz PVXCARDXKYFJSO-UHFFFAOYSA-N 1 1 345.830 4.364 20 5 EIBDMO CCN1CC[C@@H]([N@@H+](C)Cc2c3ccccc3cc3ccccc32)CC1=O ZINC001172046679 1049843417 /nfs/dbraw/zinc/84/34/17/1049843417.db2.gz RFIXDIAPHRKYEB-LJQANCHMSA-N 1 1 346.474 4.436 20 5 EIBDMO CCn1ccc(C[N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)c1 ZINC000616737765 1049916176 /nfs/dbraw/zinc/91/61/76/1049916176.db2.gz UCKBMXQVZBSOAK-UHFFFAOYSA-N 1 1 339.395 4.308 20 5 EIBDMO Cc1ccc(C[NH2+]Cc2c(Br)cccc2[N+](=O)[O-])c(C)c1 ZINC001177323194 1050193112 /nfs/dbraw/zinc/19/31/12/1050193112.db2.gz GHOSIQINDRAAPP-UHFFFAOYSA-N 1 1 349.228 4.264 20 5 EIBDMO CC[N@@H+](Cc1cccs1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172922174 1050236503 /nfs/dbraw/zinc/23/65/03/1050236503.db2.gz WSCRKBITNFWQOP-MRXNPFEDSA-N 1 1 330.453 4.426 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCC[C@H]1c1cccnc1)CC2 ZINC001172910381 1050245946 /nfs/dbraw/zinc/24/59/46/1050245946.db2.gz YJKFXNMIFUTZED-ICSRJNTNSA-N 1 1 337.423 4.074 20 5 EIBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNCc2c(C)ccc([N+](=O)[O-])c2C)C1 ZINC001177835698 1050312331 /nfs/dbraw/zinc/31/23/31/1050312331.db2.gz USUVARPHBOTOFY-KRWDZBQOSA-N 1 1 347.503 4.202 20 5 EIBDMO CC[C@H]1CCCN(C(C)(C)C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)C1 ZINC001177835698 1050312339 /nfs/dbraw/zinc/31/23/39/1050312339.db2.gz USUVARPHBOTOFY-KRWDZBQOSA-N 1 1 347.503 4.202 20 5 EIBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC23CCCCC3)c1F ZINC001173182829 1050338420 /nfs/dbraw/zinc/33/84/20/1050338420.db2.gz UMJOWDJDEIDLSM-CYBMUJFWSA-N 1 1 336.407 4.082 20 5 EIBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)CC2CCCCC2)c1F ZINC001173195174 1050340331 /nfs/dbraw/zinc/34/03/31/1050340331.db2.gz CURLIWVZAPZQRR-CYBMUJFWSA-N 1 1 338.423 4.186 20 5 EIBDMO COc1ccc([C@H]2CCC[N@H+]2[C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173225486 1050357015 /nfs/dbraw/zinc/35/70/15/1050357015.db2.gz CMGVGEQBMYWUDM-FOIQADDNSA-N 1 1 340.423 4.372 20 5 EIBDMO COc1ccccc1[C@@H]1CC[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173228973 1050357683 /nfs/dbraw/zinc/35/76/83/1050357683.db2.gz OWXKJYJRCFVPIA-DOTOQJQBSA-N 1 1 340.423 4.024 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCSc2ccccc2C1 ZINC001173230811 1050358730 /nfs/dbraw/zinc/35/87/30/1050358730.db2.gz GROYWKKNEURFRC-CQSZACIVSA-N 1 1 328.437 4.134 20 5 EIBDMO CC(C)(C)[N@H+]1CC[C@H](CNc2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC001187014307 1050459457 /nfs/dbraw/zinc/45/94/57/1050459457.db2.gz PDLQCHUOVDXZIS-LLVKDONJSA-N 1 1 345.365 4.146 20 5 EIBDMO C/C(=C/c1ccccc1)C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000775107761 1050504292 /nfs/dbraw/zinc/50/42/92/1050504292.db2.gz KRAHIWLWVWNNIY-UVTDQMKNSA-N 1 1 341.367 4.038 20 5 EIBDMO C/C(=C/c1ccccc1)C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000775107761 1050504312 /nfs/dbraw/zinc/50/43/12/1050504312.db2.gz KRAHIWLWVWNNIY-UVTDQMKNSA-N 1 1 341.367 4.038 20 5 EIBDMO C[C@@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC000775189462 1050826678 /nfs/dbraw/zinc/82/66/78/1050826678.db2.gz AXNUHWGASOXFMW-SNVBAGLBSA-N 1 1 335.747 4.007 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000619784536 1050901159 /nfs/dbraw/zinc/90/11/59/1050901159.db2.gz YJCHGQNRYSCIET-CQSZACIVSA-N 1 1 346.324 4.288 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000619784536 1050901175 /nfs/dbraw/zinc/90/11/75/1050901175.db2.gz YJCHGQNRYSCIET-CQSZACIVSA-N 1 1 346.324 4.288 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cccc2cnccc21)C1CC1 ZINC000183062889 1050950020 /nfs/dbraw/zinc/95/00/20/1050950020.db2.gz DVNADEFCYHARSW-UHFFFAOYSA-N 1 1 333.391 4.308 20 5 EIBDMO CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccc(F)cc1 ZINC001190474045 1051193962 /nfs/dbraw/zinc/19/39/62/1051193962.db2.gz CGBUXAAIKXYEFI-AWEZNQCLSA-N 1 1 332.375 4.196 20 5 EIBDMO Cc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)nc1Cl ZINC001190529578 1051206976 /nfs/dbraw/zinc/20/69/76/1051206976.db2.gz UAPVANKVVDLCOI-UHFFFAOYSA-N 1 1 333.819 4.362 20 5 EIBDMO C[C@]1(c2ccccc2)CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC001190943702 1051309259 /nfs/dbraw/zinc/30/92/59/1051309259.db2.gz BKSWILDHXIYJOV-FQEVSTJZSA-N 1 1 340.423 4.027 20 5 EIBDMO CCC[C@]1(C)CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC001191258257 1051397015 /nfs/dbraw/zinc/39/70/15/1051397015.db2.gz LRBHXUIIIZMSED-LJQANCHMSA-N 1 1 347.459 4.134 20 5 EIBDMO CC(C)[C@@H]1[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1(C)C ZINC001182101117 1051398870 /nfs/dbraw/zinc/39/88/70/1051398870.db2.gz YUPZMGSUAFBGKJ-AWEZNQCLSA-N 1 1 330.350 4.480 20 5 EIBDMO C[C@@H]1C[C@H](C(C)(C)C)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC001182182842 1051412383 /nfs/dbraw/zinc/41/23/83/1051412383.db2.gz FTUVYVUGUJIMKH-CHWSQXEVSA-N 1 1 331.416 4.383 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCc2ccccc2[C@H]1C(C)C ZINC001191539293 1051476764 /nfs/dbraw/zinc/47/67/64/1051476764.db2.gz FUWWLRLSOUZBPS-HXUWFJFHSA-N 1 1 340.423 4.359 20 5 EIBDMO COc1ccc([C@H](C)C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC001191683119 1051522027 /nfs/dbraw/zinc/52/20/27/1051522027.db2.gz UWCJBXJWNCNSMU-OAHLLOKOSA-N 1 1 340.423 4.372 20 5 EIBDMO CC(C)Oc1ccc(-c2cccc([C@H](C)[N@@H+](C)CC[N+](=O)[O-])c2)cc1 ZINC001192197377 1051654163 /nfs/dbraw/zinc/65/41/63/1051654163.db2.gz GAYQBEBTBSFOCL-INIZCTEOSA-N 1 1 342.439 4.410 20 5 EIBDMO Cc1c(C[N@@H+]2CCC[C@H](c3cc(C(C)C)n[nH]3)C2)cccc1[N+](=O)[O-] ZINC001175927592 1051845545 /nfs/dbraw/zinc/84/55/45/1051845545.db2.gz ZVHUEYJERQEXHN-INIZCTEOSA-N 1 1 342.443 4.129 20 5 EIBDMO Cc1c(C[N@H+]2CCC[C@H](c3cc(C(C)C)[nH]n3)C2)cccc1[N+](=O)[O-] ZINC001175927592 1051845548 /nfs/dbraw/zinc/84/55/48/1051845548.db2.gz ZVHUEYJERQEXHN-INIZCTEOSA-N 1 1 342.443 4.129 20 5 EIBDMO Cc1c(C[N@@H+]2CCC[C@H](c3cc(C(C)C)[nH]n3)C2)cccc1[N+](=O)[O-] ZINC001175927592 1051845549 /nfs/dbraw/zinc/84/55/49/1051845549.db2.gz ZVHUEYJERQEXHN-INIZCTEOSA-N 1 1 342.443 4.129 20 5 EIBDMO Cc1nc(-c2ccccc2)oc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC001176036427 1051881206 /nfs/dbraw/zinc/88/12/06/1051881206.db2.gz LUIJDQBSBUBIKJ-ZDUSSCGKSA-N 1 1 337.379 4.409 20 5 EIBDMO CC(C)CCc1nc(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cs1 ZINC001193743770 1051980988 /nfs/dbraw/zinc/98/09/88/1051980988.db2.gz UGZOZCRHOSJMHV-UHFFFAOYSA-N 1 1 347.484 4.314 20 5 EIBDMO CC(C)CCc1nc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cs1 ZINC001193743770 1051980997 /nfs/dbraw/zinc/98/09/97/1051980997.db2.gz UGZOZCRHOSJMHV-UHFFFAOYSA-N 1 1 347.484 4.314 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1[C@@H](C)c1ccccc1 ZINC001176366160 1052043144 /nfs/dbraw/zinc/04/31/44/1052043144.db2.gz XYWLHSQOKKSYBX-HNAYVOBHSA-N 1 1 340.423 4.372 20 5 EIBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cc(Cl)cc2c1OCC2 ZINC001176441258 1052057636 /nfs/dbraw/zinc/05/76/36/1052057636.db2.gz JLKHRIJJCHRIPJ-NSHDSACASA-N 1 1 332.787 4.034 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cc(Cl)cc2c1OCC2 ZINC001176441255 1052058123 /nfs/dbraw/zinc/05/81/23/1052058123.db2.gz JLKHRIJJCHRIPJ-LLVKDONJSA-N 1 1 332.787 4.034 20 5 EIBDMO COc1ccc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)cc1C ZINC001176628932 1052147044 /nfs/dbraw/zinc/14/70/44/1052147044.db2.gz CAXBQNVLQNZPKQ-GFCCVEGCSA-N 1 1 334.803 4.416 20 5 EIBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCC[C@@H]1/C=C\c1ccccc1 ZINC001176639477 1052148482 /nfs/dbraw/zinc/14/84/82/1052148482.db2.gz HNNBBVRHPREXJO-IBWPDUFMSA-N 1 1 326.371 4.412 20 5 EIBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@@H]1/C=C\c1ccccc1 ZINC001176639477 1052148487 /nfs/dbraw/zinc/14/84/87/1052148487.db2.gz HNNBBVRHPREXJO-IBWPDUFMSA-N 1 1 326.371 4.412 20 5 EIBDMO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000774827197 1052164086 /nfs/dbraw/zinc/16/40/86/1052164086.db2.gz OYYWUEBVQWAZAU-KRWDZBQOSA-N 1 1 341.367 4.149 20 5 EIBDMO Cc1ccc([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000774827197 1052164094 /nfs/dbraw/zinc/16/40/94/1052164094.db2.gz OYYWUEBVQWAZAU-KRWDZBQOSA-N 1 1 341.367 4.149 20 5 EIBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H]1CCCc2ccccc21 ZINC000774820123 1052169390 /nfs/dbraw/zinc/16/93/90/1052169390.db2.gz WDAHWBFIDWCHKB-QGZVFWFLSA-N 1 1 341.367 4.012 20 5 EIBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H]1CCCc2ccccc21 ZINC000774820123 1052169396 /nfs/dbraw/zinc/16/93/96/1052169396.db2.gz WDAHWBFIDWCHKB-QGZVFWFLSA-N 1 1 341.367 4.012 20 5 EIBDMO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H](C)c1ccc(F)cc1 ZINC000774845763 1052205150 /nfs/dbraw/zinc/20/51/50/1052205150.db2.gz KWAXXJFEWCTENJ-GFCCVEGCSA-N 1 1 347.346 4.225 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H](C)c1ccc(F)cc1 ZINC000774845763 1052205160 /nfs/dbraw/zinc/20/51/60/1052205160.db2.gz KWAXXJFEWCTENJ-GFCCVEGCSA-N 1 1 347.346 4.225 20 5 EIBDMO CC(C)[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccc(F)cc1 ZINC000083132208 1052833239 /nfs/dbraw/zinc/83/32/39/1052833239.db2.gz JYZWSILGEUTKPD-SFHVURJKSA-N 1 1 343.358 4.362 20 5 EIBDMO CC[N@@H+](C[C@@H](O)c1ccc(C)cc1)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000764282158 1053051900 /nfs/dbraw/zinc/05/19/00/1053051900.db2.gz CIPIAKCNYJMWRM-DNVCBOLYSA-N 1 1 328.412 4.020 20 5 EIBDMO Cc1noc(C[NH2+][C@H](c2ccccc2)C2CCCCC2)c1[N+](=O)[O-] ZINC000851885307 1053529047 /nfs/dbraw/zinc/52/90/47/1053529047.db2.gz ZBYNUPCKVKEQSF-QGZVFWFLSA-N 1 1 329.400 4.302 20 5 EIBDMO CCCC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccc(C)o1 ZINC000776579606 1053564243 /nfs/dbraw/zinc/56/42/43/1053564243.db2.gz NZKHNCYLYJXMTK-MAUKXSAKSA-N 1 1 346.427 4.393 20 5 EIBDMO Cc1ccc(C)c([C@H]2CCC[N@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000776585872 1053567829 /nfs/dbraw/zinc/56/78/29/1053567829.db2.gz BMMIOFRYYJYMTG-WOJBJXKFSA-N 1 1 340.423 4.082 20 5 EIBDMO Cc1ccc(C)c([C@H]2CCC[N@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000776585870 1053568783 /nfs/dbraw/zinc/56/87/83/1053568783.db2.gz BMMIOFRYYJYMTG-UXHICEINSA-N 1 1 340.423 4.082 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCC[C@H](OC4CCC4)CC3)c2c1 ZINC000866145727 1053644397 /nfs/dbraw/zinc/64/43/97/1053644397.db2.gz PMPDGIHKUXBJMU-INIZCTEOSA-N 1 1 341.411 4.071 20 5 EIBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H](C3CCCCC3)C2)c1 ZINC001196410142 1053665713 /nfs/dbraw/zinc/66/57/13/1053665713.db2.gz NKSGZBYLMFPRBV-QGZVFWFLSA-N 1 1 332.444 4.266 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc(OC(F)F)cc1F)c1ccc([N+](=O)[O-])cc1 ZINC000866541265 1053775022 /nfs/dbraw/zinc/77/50/22/1053775022.db2.gz KACDTHYYQIPFPY-SNVBAGLBSA-N 1 1 340.301 4.186 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCCC[C@@H]2C[C@@H](O)c2ccco2)cc1 ZINC000121901328 1053855204 /nfs/dbraw/zinc/85/52/04/1053855204.db2.gz YUBGZGJTXZEFQW-QZTJIDSGSA-N 1 1 344.411 4.056 20 5 EIBDMO C[C@@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC001197658204 1053961069 /nfs/dbraw/zinc/96/10/69/1053961069.db2.gz DXHLFUWIKWMQOO-BEFAXECRSA-N 1 1 326.396 4.057 20 5 EIBDMO C[C@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC001197658225 1053961193 /nfs/dbraw/zinc/96/11/93/1053961193.db2.gz DXHLFUWIKWMQOO-KXBFYZLASA-N 1 1 326.396 4.057 20 5 EIBDMO C[C@H](NCc1cccc(C[NH+]2CCCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000173306378 1053970519 /nfs/dbraw/zinc/97/05/19/1053970519.db2.gz LNMCXVOWGFALSZ-INIZCTEOSA-N 1 1 339.439 4.041 20 5 EIBDMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1ccc([N+](=O)[O-])cc1Br ZINC001168570332 1054117578 /nfs/dbraw/zinc/11/75/78/1054117578.db2.gz MWWXAUHFUPBMIS-PWSUYJOCSA-N 1 1 327.222 4.120 20 5 EIBDMO CC(C)[N@H+](C)Cc1cccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173358224 1054172731 /nfs/dbraw/zinc/17/27/31/1054172731.db2.gz NMFZGKHGPMFUTO-INIZCTEOSA-N 1 1 341.455 4.286 20 5 EIBDMO CC(C)[N@@H+](C)Cc1cccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173358224 1054172735 /nfs/dbraw/zinc/17/27/35/1054172735.db2.gz NMFZGKHGPMFUTO-INIZCTEOSA-N 1 1 341.455 4.286 20 5 EIBDMO COc1cccc(C2([NH2+]Cc3ccc([N+](=O)[O-])cc3Cl)CC2)c1 ZINC000272945986 1054173093 /nfs/dbraw/zinc/17/30/93/1054173093.db2.gz LVGUBKYMQFJXQN-UHFFFAOYSA-N 1 1 332.787 4.036 20 5 EIBDMO CC[N@@H+](C)Cc1cccc(CN[C@H](C)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000872035771 1054352600 /nfs/dbraw/zinc/35/26/00/1054352600.db2.gz YSLLSFUYCAOSGR-CQSZACIVSA-N 1 1 345.418 4.036 20 5 EIBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1COCc2ccccc21 ZINC000872079829 1054381280 /nfs/dbraw/zinc/38/12/80/1054381280.db2.gz LCIFEIJNMDJZAO-YVEFUNNKSA-N 1 1 344.436 4.239 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H](c2ccccn2)C2CCC2)c1 ZINC000858239800 1054445700 /nfs/dbraw/zinc/44/57/00/1054445700.db2.gz XHYSFVDURSLPKR-KRWDZBQOSA-N 1 1 331.803 4.274 20 5 EIBDMO O=[N+]([O-])c1cc(O)cc(Nc2ccc([NH+]3CCCCCC3)cc2)c1 ZINC001201222970 1054730261 /nfs/dbraw/zinc/73/02/61/1054730261.db2.gz UPSAUENDMZSBIL-UHFFFAOYSA-N 1 1 327.384 4.424 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cc(C(C)(C)C)oc1C ZINC001201634157 1054860435 /nfs/dbraw/zinc/86/04/35/1054860435.db2.gz OZIJFKWXSOBQKM-UHFFFAOYSA-N 1 1 332.400 4.092 20 5 EIBDMO Cc1csc([C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])c(Cl)c3)C2)n1 ZINC000877813656 1055125213 /nfs/dbraw/zinc/12/52/13/1055125213.db2.gz IVOYHTBMEVCSQB-GFCCVEGCSA-N 1 1 337.832 4.003 20 5 EIBDMO Cc1nn(C(C)(C)C)c(C)c1C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000877827823 1055130406 /nfs/dbraw/zinc/13/04/06/1055130406.db2.gz TZTVKYQVFFWDNY-GFCCVEGCSA-N 1 1 330.432 4.014 20 5 EIBDMO CC[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CCCC[C@@H]1C ZINC000878474793 1055319740 /nfs/dbraw/zinc/31/97/40/1055319740.db2.gz FMQOIDIXOVZRKL-ZFWWWQNUSA-N 1 1 344.415 4.045 20 5 EIBDMO CC(C)(C)[C@H](NCc1cc([O-])ccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000553370767 1055428306 /nfs/dbraw/zinc/42/83/06/1055428306.db2.gz JOQDGABRRHQNBA-QGZVFWFLSA-N 1 1 332.375 4.317 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCc3cn(C(C)C)nc32)cc1[N+](=O)[O-] ZINC000765825833 1055804978 /nfs/dbraw/zinc/80/49/78/1055804978.db2.gz WKRFTZYDOKVGQW-WMLDXEAASA-N 1 1 342.443 4.409 20 5 EIBDMO CC[C@H](Cc1ccc(C)cc1)[N@@H+](CC)Cn1nc(C)c([N+](=O)[O-])c1C ZINC000742177406 1058549282 /nfs/dbraw/zinc/54/92/82/1058549282.db2.gz FKXHOOOCTJSYTQ-GOSISDBHSA-N 1 1 344.459 4.017 20 5 EIBDMO Cc1ccc(N2CCC[N@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000743843591 1059137394 /nfs/dbraw/zinc/13/73/94/1059137394.db2.gz YXRHXTQKOMJUSI-KRWDZBQOSA-N 1 1 339.439 4.177 20 5 EIBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)c1ccc(C)cc1 ZINC000743863602 1059198163 /nfs/dbraw/zinc/19/81/63/1059198163.db2.gz BEALYLATHSTRFL-GOSISDBHSA-N 1 1 348.830 4.112 20 5 EIBDMO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)c1ccc(C)cc1 ZINC000743863602 1059198210 /nfs/dbraw/zinc/19/82/10/1059198210.db2.gz BEALYLATHSTRFL-GOSISDBHSA-N 1 1 348.830 4.112 20 5 EIBDMO COc1ccc2c(c1)CCC[C@@H]2[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000746141232 1060044483 /nfs/dbraw/zinc/04/44/83/1060044483.db2.gz SVORCCVZJXAQCY-IBGZPJMESA-N 1 1 344.386 4.252 20 5 EIBDMO C[N@@H+](Cc1cccc(Oc2ccccc2)c1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 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XFAQJPVXKKTZSZ-SFHVURJKSA-N 1 1 329.400 4.262 20 5 EIBDMO CC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000525127558 1029466761 /nfs/dbraw/zinc/46/67/61/1029466761.db2.gz IGRAJCKDUVYAPV-KRWDZBQOSA-N 1 1 328.412 4.057 20 5 EIBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@H]1CCCC[C@H]1O ZINC000428472595 1029904149 /nfs/dbraw/zinc/90/41/49/1029904149.db2.gz JCSVGSWLGULNCB-IAGOWNOFSA-N 1 1 346.452 4.059 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+](CC3CC3)C3CCC3)cs2)c1 ZINC000475669408 1030374664 /nfs/dbraw/zinc/37/46/64/1030374664.db2.gz DHPCTROCNRZORS-UHFFFAOYSA-N 1 1 343.452 4.483 20 5 EIBDMO CCOc1cc(C[N@@H+]2CC[C@@H](C(F)(F)F)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000451410577 1030472965 /nfs/dbraw/zinc/47/29/65/1030472965.db2.gz SRRAVWQIALQGJQ-DGCLKSJQSA-N 1 1 346.349 4.156 20 5 EIBDMO CCOc1cc(C[N@H+]2CC[C@@H](C(F)(F)F)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000451410577 1030472971 /nfs/dbraw/zinc/47/29/71/1030472971.db2.gz SRRAVWQIALQGJQ-DGCLKSJQSA-N 1 1 346.349 4.156 20 5 EIBDMO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC ZINC000179731479 1031280967 /nfs/dbraw/zinc/28/09/67/1031280967.db2.gz CZVXXDHRBHGNID-QGZVFWFLSA-N 1 1 344.411 4.243 20 5 EIBDMO CC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@H](C)c1ccc(F)cc1 ZINC000516198725 1031319081 /nfs/dbraw/zinc/31/90/81/1031319081.db2.gz ZUVLXDDIAVGXHD-CYBMUJFWSA-N 1 1 332.375 4.326 20 5 EIBDMO COc1ccc(C[N@@H+]2[C@H](C)[C@@H](CC(F)(F)F)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000449357992 1031678769 /nfs/dbraw/zinc/67/87/69/1031678769.db2.gz BNZAAEXLNSVRML-DMDPSCGWSA-N 1 1 346.349 4.155 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](CC(=O)OC(C)(C)C)C1 ZINC000532124860 1032054222 /nfs/dbraw/zinc/05/42/22/1032054222.db2.gz KEFIRLAXHQPQCY-CABCVRRESA-N 1 1 348.443 4.100 20 5 EIBDMO CCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCc2cccnc21 ZINC000614215657 1033802698 /nfs/dbraw/zinc/80/26/98/1033802698.db2.gz VHNZASGYNLMSHF-IBGZPJMESA-N 1 1 339.439 4.322 20 5 EIBDMO CC1(C)C[C@H]([NH2+]Cc2cc(F)ccc2F)c2cc([N+](=O)[O-])ccc21 ZINC000433168334 1033981291 /nfs/dbraw/zinc/98/12/91/1033981291.db2.gz MKUUBTRPSGETHI-KRWDZBQOSA-N 1 1 332.350 4.385 20 5 EIBDMO CC(C)[N@@H+]1CCC[C@@H](CN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433172795 1033990973 /nfs/dbraw/zinc/99/09/73/1033990973.db2.gz DMIDMUCHSUUPFY-KXBFYZLASA-N 1 1 345.487 4.027 20 5 EIBDMO CC(C)[N@H+]1CCC[C@@H](CN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433172795 1033990982 /nfs/dbraw/zinc/99/09/82/1033990982.db2.gz DMIDMUCHSUUPFY-KXBFYZLASA-N 1 1 345.487 4.027 20 5 EIBDMO C[N@H+]1CC[C@@H](Nc2nc3ccccc3cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000473519194 1034738623 /nfs/dbraw/zinc/73/86/23/1034738623.db2.gz MYHSLWFUFZJFLR-MJGOQNOKSA-N 1 1 348.406 4.000 20 5 EIBDMO C[C@H]1C[C@H](c2ccccc2)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000513235864 1034851631 /nfs/dbraw/zinc/85/16/31/1034851631.db2.gz GFUTXUNPUANJQK-SCLBCKFNSA-N 1 1 336.395 4.054 20 5 EIBDMO C[C@H]1C[C@H](c2ccccc2)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000513235864 1034851634 /nfs/dbraw/zinc/85/16/34/1034851634.db2.gz GFUTXUNPUANJQK-SCLBCKFNSA-N 1 1 336.395 4.054 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH2+][C@H]2CCCOc3c(Cl)cccc32)cs1 ZINC000345695099 1035282818 /nfs/dbraw/zinc/28/28/18/1035282818.db2.gz SGWBPOPGZLRWMB-ZDUSSCGKSA-N 1 1 338.816 4.313 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCCOc3cc(Cl)ccc32)cs1 ZINC000345703171 1035283630 /nfs/dbraw/zinc/28/36/30/1035283630.db2.gz HRIVPUUYONGBSY-CYBMUJFWSA-N 1 1 338.816 4.313 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C1(c2ccc(F)cc2)CC1 ZINC000595023365 1035510993 /nfs/dbraw/zinc/51/09/93/1035510993.db2.gz PVKYIYSGZXGMOC-GFCCVEGCSA-N 1 1 330.359 4.082 20 5 EIBDMO C[NH+](C)CC(C)(C)CNCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000237093695 1035579898 /nfs/dbraw/zinc/57/98/98/1035579898.db2.gz SEJDHLRJVBEAKQ-UHFFFAOYSA-N 1 1 347.484 4.001 20 5 EIBDMO CN(C)CC(C)(C)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000237093695 1035579917 /nfs/dbraw/zinc/57/99/17/1035579917.db2.gz SEJDHLRJVBEAKQ-UHFFFAOYSA-N 1 1 347.484 4.001 20 5 EIBDMO Cc1noc(C[N@H+](C)[C@@H](C)[C@@H](C)c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000595334487 1035632201 /nfs/dbraw/zinc/63/22/01/1035632201.db2.gz QYBHFRFVRBCKES-PWSUYJOCSA-N 1 1 337.807 4.169 20 5 EIBDMO CC[N@@H+](Cc1ccc(OC)c(OC)c1)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000485070514 1035659161 /nfs/dbraw/zinc/65/91/61/1035659161.db2.gz CYACQEPXTWQXQK-CQSZACIVSA-N 1 1 344.411 4.195 20 5 EIBDMO Cc1noc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)c1[N+](=O)[O-] ZINC000595424396 1035676718 /nfs/dbraw/zinc/67/67/18/1035676718.db2.gz MDELOOKHJBMKFV-JBCWJZNQSA-N 1 1 335.791 4.032 20 5 EIBDMO Cc1noc(C[NH2+][C@@H](c2ccc(CC(C)C)cc2)C2CC2)c1[N+](=O)[O-] ZINC000595426390 1035677288 /nfs/dbraw/zinc/67/72/88/1035677288.db2.gz URVJYOBVYBPJFA-SFHVURJKSA-N 1 1 343.427 4.331 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](CC(F)F)c1ccccc1 ZINC000421000883 1035941356 /nfs/dbraw/zinc/94/13/56/1035941356.db2.gz WQYTYQUPOYIJKP-HNNXBMFYSA-N 1 1 336.338 4.090 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC=C(c2ccc(O)cc2)CC1 ZINC000485748394 1036241559 /nfs/dbraw/zinc/24/15/59/1036241559.db2.gz WSJKYQJXNBOWKU-OAHLLOKOSA-N 1 1 338.407 4.459 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[NH2+][C@H]3CCCc4ccc(F)cc43)nc2c1 ZINC000602637521 1036549503 /nfs/dbraw/zinc/54/95/03/1036549503.db2.gz DIKAODWWYZYSGK-HNNXBMFYSA-N 1 1 341.342 4.042 20 5 EIBDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000603840687 1037025140 /nfs/dbraw/zinc/02/51/40/1037025140.db2.gz SQTMHPWJINREDY-LBPRGKRZSA-N 1 1 334.803 4.450 20 5 EIBDMO COc1ccc(C[N@@H+](C)[C@@H]2CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000603837224 1037032733 /nfs/dbraw/zinc/03/27/33/1037032733.db2.gz LVZZTYVUSWWQNL-QGZVFWFLSA-N 1 1 326.396 4.113 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@H]2c2ccccc2C)cc1[N+](=O)[O-] ZINC000603857527 1037050435 /nfs/dbraw/zinc/05/04/35/1037050435.db2.gz WPFQDHXFXIJYTG-KRWDZBQOSA-N 1 1 326.396 4.249 20 5 EIBDMO C[C@H]1CCC[N@@H+](CCCCNc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000603860174 1037069664 /nfs/dbraw/zinc/06/96/64/1037069664.db2.gz YNGIHBWFXYWHLL-HNNXBMFYSA-N 1 1 342.443 4.067 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCCC4(CC4)CC3)co2)cc1 ZINC000599673363 1037115071 /nfs/dbraw/zinc/11/50/71/1037115071.db2.gz PODRWASJXYDFSJ-UHFFFAOYSA-N 1 1 327.384 4.016 20 5 EIBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@H]2c2ccccc2)cc1 ZINC000604012594 1037148335 /nfs/dbraw/zinc/14/83/35/1037148335.db2.gz TZEQSWFGZPWQSG-IBGZPJMESA-N 1 1 326.396 4.201 20 5 EIBDMO COc1cc(C)c(C[N@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000487583075 1037161916 /nfs/dbraw/zinc/16/19/16/1037161916.db2.gz ITHVDRITLOQXOS-AWEZNQCLSA-N 1 1 344.411 4.113 20 5 EIBDMO COc1cc(C)c(C[N@@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000487583075 1037161929 /nfs/dbraw/zinc/16/19/29/1037161929.db2.gz ITHVDRITLOQXOS-AWEZNQCLSA-N 1 1 344.411 4.113 20 5 EIBDMO COc1cccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC(C)C)c1 ZINC000604494657 1037407166 /nfs/dbraw/zinc/40/71/66/1037407166.db2.gz RXFPSSOFGTVTSE-UHFFFAOYSA-N 1 1 328.412 4.262 20 5 EIBDMO C[C@@H](N[C@@H]1CCC[NH2+]CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000591578334 1037504517 /nfs/dbraw/zinc/50/45/17/1037504517.db2.gz RGEGGTAHJCQEHT-ZIAGYGMSSA-N 1 1 345.468 4.116 20 5 EIBDMO Cc1cc(NCc2csc([N+](=O)[O-])c2)c[nH+]c1N1CCCC[C@H]1C ZINC000503954271 1038046598 /nfs/dbraw/zinc/04/65/98/1038046598.db2.gz XXBVUTBSRPALJC-CYBMUJFWSA-N 1 1 346.456 4.351 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000490056590 1038325076 /nfs/dbraw/zinc/32/50/76/1038325076.db2.gz PXYXSTSUQVJDED-NVXWUHKLSA-N 1 1 325.412 4.232 20 5 EIBDMO COC[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000490067365 1038330115 /nfs/dbraw/zinc/33/01/15/1038330115.db2.gz NWTFFWOAUBBTJA-QGZVFWFLSA-N 1 1 334.803 4.068 20 5 EIBDMO COC[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000490067365 1038330125 /nfs/dbraw/zinc/33/01/25/1038330125.db2.gz NWTFFWOAUBBTJA-QGZVFWFLSA-N 1 1 334.803 4.068 20 5 EIBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@@H]1CC=CCC1 ZINC001168405435 1038388093 /nfs/dbraw/zinc/38/80/93/1038388093.db2.gz YPDAPHYACZQBQD-GFCCVEGCSA-N 1 1 328.334 4.402 20 5 EIBDMO C[C@@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1cccc([N+](=O)[O-])c1 ZINC000594926146 1038428433 /nfs/dbraw/zinc/42/84/33/1038428433.db2.gz SPWZTCZGVJBMPS-GFCCVEGCSA-N 1 1 330.359 4.126 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2nc(C[NH2+]C3(c4ccccc4)CC3)co2)cc1 ZINC000539260687 1038916940 /nfs/dbraw/zinc/91/69/40/1038916940.db2.gz ROIMVASXGLYBGN-UHFFFAOYSA-N 1 1 335.363 4.029 20 5 EIBDMO CCC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000537635583 1039318535 /nfs/dbraw/zinc/31/85/35/1039318535.db2.gz DMZYTCPULDMQFK-HGTDOAKYSA-N 1 1 344.455 4.134 20 5 EIBDMO CC(C)C[C@@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000534842741 1039817102 /nfs/dbraw/zinc/81/71/02/1039817102.db2.gz KKOVDEZPOXAIJX-AWEZNQCLSA-N 1 1 329.400 4.118 20 5 EIBDMO Cc1[nH+]ccn1CCCOc1ccc(-c2ccccc2)cc1[N+](=O)[O-] ZINC000537653809 1039859602 /nfs/dbraw/zinc/85/96/02/1039859602.db2.gz APAHMBMFMQJTDL-UHFFFAOYSA-N 1 1 337.379 4.236 20 5 EIBDMO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)s1 ZINC000122135315 1039882895 /nfs/dbraw/zinc/88/28/95/1039882895.db2.gz NQLQAIMPYGSDJS-CYBMUJFWSA-N 1 1 333.457 4.424 20 5 EIBDMO CC1=C(C)C[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000482452193 1040262385 /nfs/dbraw/zinc/26/23/85/1040262385.db2.gz AJHTWZCMNICBGX-UHFFFAOYSA-N 1 1 329.425 4.260 20 5 EIBDMO CC1=C(C)C[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000482452193 1040262402 /nfs/dbraw/zinc/26/24/02/1040262402.db2.gz AJHTWZCMNICBGX-UHFFFAOYSA-N 1 1 329.425 4.260 20 5 EIBDMO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000482517580 1040313246 /nfs/dbraw/zinc/31/32/46/1040313246.db2.gz ZSVQUNJOXIGPFU-DSOSXZHWSA-N 1 1 328.334 4.271 20 5 EIBDMO C[C@@H]1[C@H](C(F)(F)F)CCC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000482517579 1040313771 /nfs/dbraw/zinc/31/37/71/1040313771.db2.gz ZSVQUNJOXIGPFU-CGDMSBDMSA-N 1 1 328.334 4.271 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH2+]C2(c3ccc(F)cc3F)CCCC2)cs1 ZINC000089801922 1040373453 /nfs/dbraw/zinc/37/34/53/1040373453.db2.gz QYEUDJRZBHMVBR-UHFFFAOYSA-N 1 1 338.379 4.494 20 5 EIBDMO C[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCC(C)(C)C1 ZINC000483114247 1040712473 /nfs/dbraw/zinc/71/24/73/1040712473.db2.gz WIHZIIWYGVYUNT-INIZCTEOSA-N 1 1 329.400 4.260 20 5 EIBDMO C[C@H]1C[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C(C)(C)C1 ZINC000539829044 1040824033 /nfs/dbraw/zinc/82/40/33/1040824033.db2.gz UMLUFCMVHUFPLX-GFCCVEGCSA-N 1 1 331.441 4.339 20 5 EIBDMO O=[N+]([O-])c1cc(Br)ccc1C[NH2+]C1(c2ccccc2)CC1 ZINC000425451362 1040838075 /nfs/dbraw/zinc/83/80/75/1040838075.db2.gz BJDFVPCSHZJSCM-UHFFFAOYSA-N 1 1 347.212 4.136 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cccc(OC(C)(C)C)n1 ZINC000537940993 1040908738 /nfs/dbraw/zinc/90/87/38/1040908738.db2.gz DSBBHAZWDUMURX-CQSZACIVSA-N 1 1 343.427 4.326 20 5 EIBDMO Cc1c([C@H](C)[NH2+]Cc2cccc(OC(C)(C)C)n2)cccc1[N+](=O)[O-] ZINC000537940948 1040909260 /nfs/dbraw/zinc/90/92/60/1040909260.db2.gz CGDAYXKYMZXRHE-AWEZNQCLSA-N 1 1 343.427 4.326 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+][C@@H]2COc3ccc(Cl)cc32)cc1[N+](=O)[O-] ZINC000537956262 1040924860 /nfs/dbraw/zinc/92/48/60/1040924860.db2.gz IYFCMSVXEFRRAX-XHDPSFHLSA-N 1 1 332.787 4.341 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+][C@@H]2c3ccc(F)cc3O[C@@H]2C)cc1[N+](=O)[O-] ZINC000554374087 1041058316 /nfs/dbraw/zinc/05/83/16/1041058316.db2.gz POPOTGAZFYJXDG-IUUKEHGRSA-N 1 1 330.359 4.215 20 5 EIBDMO C[C@H](CCO)[N@@H+](Cc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000540054595 1041077847 /nfs/dbraw/zinc/07/78/47/1041077847.db2.gz ZJUHJYSAPYWBJK-CQSZACIVSA-N 1 1 348.830 4.021 20 5 EIBDMO CC(C)[C@@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000538812951 1041549258 /nfs/dbraw/zinc/54/92/58/1041549258.db2.gz RCIGGWXHHZJUTO-CQSZACIVSA-N 1 1 331.441 4.196 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@H]1Cc1ccc(F)cc1 ZINC000505923569 1041593957 /nfs/dbraw/zinc/59/39/57/1041593957.db2.gz VWWHWRVJWROTPJ-HNNXBMFYSA-N 1 1 332.350 4.080 20 5 EIBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H](C)c1cccc(OC)c1 ZINC000516616628 1041675052 /nfs/dbraw/zinc/67/50/52/1041675052.db2.gz VNOLRRKQKYJVAW-HNNXBMFYSA-N 1 1 328.412 4.495 20 5 EIBDMO C[C@H](CC(F)(F)F)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000463718295 1041717945 /nfs/dbraw/zinc/71/79/45/1041717945.db2.gz YPPJRTPQCVBOCX-SECBINFHSA-N 1 1 345.346 4.149 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCS[C@@H]2CCCC[C@H]21 ZINC000437535033 1041833671 /nfs/dbraw/zinc/83/36/71/1041833671.db2.gz KFKWOFLDQSFYPX-UKRRQHHQSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCS[C@@H]2CCCC[C@H]21 ZINC000437535033 1041833672 /nfs/dbraw/zinc/83/36/72/1041833672.db2.gz KFKWOFLDQSFYPX-UKRRQHHQSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCS[C@H]2CCCC[C@@H]21 ZINC000437535035 1041833885 /nfs/dbraw/zinc/83/38/85/1041833885.db2.gz KFKWOFLDQSFYPX-ZFWWWQNUSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCS[C@H]2CCCC[C@@H]21 ZINC000437535035 1041833888 /nfs/dbraw/zinc/83/38/88/1041833888.db2.gz KFKWOFLDQSFYPX-ZFWWWQNUSA-N 1 1 326.849 4.108 20 5 EIBDMO CCC[N@@H+](CCc1cccs1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000464598154 1042074414 /nfs/dbraw/zinc/07/44/14/1042074414.db2.gz ZYKWOIICKYDEMT-UHFFFAOYSA-N 1 1 334.441 4.120 20 5 EIBDMO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)s1 ZINC000541772506 1042109903 /nfs/dbraw/zinc/10/99/03/1042109903.db2.gz CNLZGCBKKWSSKG-CYBMUJFWSA-N 1 1 333.457 4.424 20 5 EIBDMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000464731291 1042135576 /nfs/dbraw/zinc/13/55/76/1042135576.db2.gz GXRHDSPFUVMPHE-XJKSGUPXSA-N 1 1 344.415 4.045 20 5 EIBDMO C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCC(C)(C)CC1 ZINC000438502370 1042213137 /nfs/dbraw/zinc/21/31/37/1042213137.db2.gz WFIHMSJFXXTFKH-UHFFFAOYSA-N 1 1 344.415 4.045 20 5 EIBDMO C[C@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H](C)C1 ZINC000443647012 1042214686 /nfs/dbraw/zinc/21/46/86/1042214686.db2.gz DCKFXUUDWJZZCP-GJZGRUSLSA-N 1 1 343.427 4.160 20 5 EIBDMO COc1ccc([C@@H](C)[N@@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])cc1 ZINC000506325966 1042315438 /nfs/dbraw/zinc/31/54/38/1042315438.db2.gz OIYWPMHFIYRGIH-PMGBHYCQSA-N 1 1 326.396 4.310 20 5 EIBDMO Cn1cc(C[N@@H+](C)CC2CCCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000506325588 1042316674 /nfs/dbraw/zinc/31/66/74/1042316674.db2.gz LPWFNANFMITNRB-UHFFFAOYSA-N 1 1 342.443 4.007 20 5 EIBDMO C[C@@H]1C[C@@H]1c1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)o1 ZINC000030153144 1042491295 /nfs/dbraw/zinc/49/12/95/1042491295.db2.gz QHEUAUYDGBOIMK-ACJLOTCBSA-N 1 1 326.396 4.476 20 5 EIBDMO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)o1 ZINC000030153144 1042491298 /nfs/dbraw/zinc/49/12/98/1042491298.db2.gz QHEUAUYDGBOIMK-ACJLOTCBSA-N 1 1 326.396 4.476 20 5 EIBDMO CCOc1cc(C[N@@H+](CC)Cc2ccc(OC)cc2)ccc1[N+](=O)[O-] ZINC000492352412 1042615845 /nfs/dbraw/zinc/61/58/45/1042615845.db2.gz AMZXIBWORVNGLF-UHFFFAOYSA-N 1 1 344.411 4.024 20 5 EIBDMO CCOc1cc(C[N@H+]2CCC[C@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000492379212 1042628275 /nfs/dbraw/zinc/62/82/75/1042628275.db2.gz WAQMQKFSKPYSHZ-HNNXBMFYSA-N 1 1 332.425 4.392 20 5 EIBDMO CC[C@@H]([NH2+]Cc1cnc(C(F)(F)F)s1)c1cccc([N+](=O)[O-])c1 ZINC000443993633 1042733609 /nfs/dbraw/zinc/73/36/09/1042733609.db2.gz MOETYSQREIUDHV-GFCCVEGCSA-N 1 1 345.346 4.311 20 5 EIBDMO CCOc1cc(C[N@@H+](C)[C@@H]2CC[C@@H](SCC)C2)ccc1[N+](=O)[O-] ZINC000492776075 1042746596 /nfs/dbraw/zinc/74/65/96/1042746596.db2.gz TZRWPXUVUQTXML-HUUCEWRRSA-N 1 1 338.473 4.100 20 5 EIBDMO COc1cccc([C@H]2CCC[N@H+]2Cc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000506690633 1042779632 /nfs/dbraw/zinc/77/96/32/1042779632.db2.gz QZCBPTLJNJJBBM-GOSISDBHSA-N 1 1 326.396 4.249 20 5 EIBDMO COc1ccc(OCC[N@@H+](CC2CC2)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000441497541 1042852831 /nfs/dbraw/zinc/85/28/31/1042852831.db2.gz CAZAOTCSQBKAQD-UHFFFAOYSA-N 1 1 348.443 4.027 20 5 EIBDMO CCC1(CC)CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000556883800 1043233939 /nfs/dbraw/zinc/23/39/39/1043233939.db2.gz ZTMRUODWYHMIJP-UHFFFAOYSA-N 1 1 342.443 4.007 20 5 EIBDMO CC(C)Cc1ncc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)s1 ZINC000507170805 1043309709 /nfs/dbraw/zinc/30/97/09/1043309709.db2.gz QHMIKTVSDXQVOC-UHFFFAOYSA-N 1 1 345.468 4.414 20 5 EIBDMO CC(C)Cc1ncc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)s1 ZINC000507170805 1043309719 /nfs/dbraw/zinc/30/97/19/1043309719.db2.gz QHMIKTVSDXQVOC-UHFFFAOYSA-N 1 1 345.468 4.414 20 5 EIBDMO CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1cccc(OC)c1 ZINC000520843832 1043401181 /nfs/dbraw/zinc/40/11/81/1043401181.db2.gz MDULDALQHCNWEX-HNNXBMFYSA-N 1 1 344.411 4.065 20 5 EIBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@H](C)C1 ZINC000443065990 1043986211 /nfs/dbraw/zinc/98/62/11/1043986211.db2.gz BRIURUOONOGOSR-ZIAGYGMSSA-N 1 1 346.452 4.323 20 5 EIBDMO CC[C@@H](C)C[N@@H+](CC)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000245936321 1044215776 /nfs/dbraw/zinc/21/57/76/1044215776.db2.gz ZMUMNLQRPFLOKV-CHWSQXEVSA-N 1 1 332.404 4.074 20 5 EIBDMO Cc1ccc([C@H]2CC[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)cc1 ZINC000543245636 1044231112 /nfs/dbraw/zinc/23/11/12/1044231112.db2.gz DSSUDNYHYIVURM-HNNXBMFYSA-N 1 1 337.379 4.034 20 5 EIBDMO C[C@H](c1cccc2ccccc21)[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000543478996 1044689922 /nfs/dbraw/zinc/68/99/22/1044689922.db2.gz MRUOKMVRRXZHOF-CQSZACIVSA-N 1 1 333.391 4.262 20 5 EIBDMO C[C@H](c1cccc2ccccc21)[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000543478996 1044689927 /nfs/dbraw/zinc/68/99/27/1044689927.db2.gz MRUOKMVRRXZHOF-CQSZACIVSA-N 1 1 333.391 4.262 20 5 EIBDMO CCCOc1ncccc1C[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000154719820 1044827322 /nfs/dbraw/zinc/82/73/22/1044827322.db2.gz BTQJBCNPFGJURY-KRWDZBQOSA-N 1 1 329.400 4.020 20 5 EIBDMO C[C@@H]1[C@H](C)SCC[N@@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000093499627 1044840031 /nfs/dbraw/zinc/84/00/31/1044840031.db2.gz VAGYNJWDYAGNKU-NEPJUHHUSA-N 1 1 349.481 4.044 20 5 EIBDMO C[C@@H]1[C@H](C)SCC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000093499627 1044840033 /nfs/dbraw/zinc/84/00/33/1044840033.db2.gz VAGYNJWDYAGNKU-NEPJUHHUSA-N 1 1 349.481 4.044 20 5 EIBDMO CC(C)C[C@H]1CCCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000466674709 1044967431 /nfs/dbraw/zinc/96/74/31/1044967431.db2.gz ZXFBOLLNEFAECW-MRXNPFEDSA-N 1 1 344.415 4.045 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@@H]3CCCc4cccnc43)o2)c1 ZINC000922880340 1045019629 /nfs/dbraw/zinc/01/96/29/1045019629.db2.gz DJJDUHZFQONCRV-GOSISDBHSA-N 1 1 349.390 4.417 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2ccc3cnccc3c2)c1 ZINC000785484169 1045101206 /nfs/dbraw/zinc/10/12/06/1045101206.db2.gz HWBHMRYBGKODNJ-UHFFFAOYSA-N 1 1 327.771 4.086 20 5 EIBDMO C[C@H](Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000302050102 1045156777 /nfs/dbraw/zinc/15/67/77/1045156777.db2.gz NKPAGNJGCMKITL-QWHCGFSZSA-N 1 1 337.851 4.313 20 5 EIBDMO C[C@@H](Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000302050101 1045157198 /nfs/dbraw/zinc/15/71/98/1045157198.db2.gz NKPAGNJGCMKITL-OLZOCXBDSA-N 1 1 337.851 4.313 20 5 EIBDMO C[C@H](Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000302050103 1045157765 /nfs/dbraw/zinc/15/77/65/1045157765.db2.gz NKPAGNJGCMKITL-STQMWFEESA-N 1 1 337.851 4.313 20 5 EIBDMO CCOc1cc(N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)ccc1[N+](=O)[O-] ZINC000302067150 1045158319 /nfs/dbraw/zinc/15/83/19/1045158319.db2.gz WODZTVBPCLTOBV-HUUCEWRRSA-N 1 1 347.459 4.058 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@@H+](C3CC3)C3CCCC3)c2c1 ZINC000915209035 1045186671 /nfs/dbraw/zinc/18/66/71/1045186671.db2.gz WRQLSRPCGSYFQI-UHFFFAOYSA-N 1 1 333.413 4.236 20 5 EIBDMO Cc1c([C@H](C)[NH2+]Cc2ccn(C3CCCC3)n2)cccc1[N+](=O)[O-] ZINC000090547102 1045211694 /nfs/dbraw/zinc/21/16/94/1045211694.db2.gz QOGNKBNQYPCBSX-AWEZNQCLSA-N 1 1 328.416 4.066 20 5 EIBDMO C[N@@H+](CCOC(C)(C)C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000611274739 1045270683 /nfs/dbraw/zinc/27/06/83/1045270683.db2.gz RLRNNXXTQWFHEZ-UHFFFAOYSA-N 1 1 332.400 4.102 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+][C@@H]2COc3c2cccc3Cl)cc1[N+](=O)[O-] ZINC000611336163 1045280914 /nfs/dbraw/zinc/28/09/14/1045280914.db2.gz XHZFVDYQQVMOJU-IAQYHMDHSA-N 1 1 332.787 4.341 20 5 EIBDMO CCOC(=O)CC[C@H]1CCC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000611516770 1045321329 /nfs/dbraw/zinc/32/13/29/1045321329.db2.gz WDUSORJMHCZAKJ-JKSUJKDBSA-N 1 1 348.443 4.020 20 5 EIBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2c(C)noc2C)cc1[N+](=O)[O-] ZINC000153789670 1045842851 /nfs/dbraw/zinc/84/28/51/1045842851.db2.gz NBBJSWVQZNDHSP-MNOVXSKESA-N 1 1 333.388 4.010 20 5 EIBDMO C[C@@H]1C[N@H+](Cc2c3ccccc3cc3ccccc32)C[C@H](C)[S@@]1=O ZINC000792191920 1045876875 /nfs/dbraw/zinc/87/68/75/1045876875.db2.gz FGZOFXSEQCUGDB-VJZPNJBGSA-N 1 1 337.488 4.334 20 5 EIBDMO CC1(C)C[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC[C@H]1C(F)(F)F ZINC000792363085 1045890930 /nfs/dbraw/zinc/89/09/30/1045890930.db2.gz MRRFGIIZDQPIGG-CYBMUJFWSA-N 1 1 334.313 4.144 20 5 EIBDMO CC1(C)C[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC[C@H]1C(F)(F)F ZINC000792363085 1045890936 /nfs/dbraw/zinc/89/09/36/1045890936.db2.gz MRRFGIIZDQPIGG-CYBMUJFWSA-N 1 1 334.313 4.144 20 5 EIBDMO CC1(C)C[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC[C@@H]1C(F)(F)F ZINC000792363086 1045891479 /nfs/dbraw/zinc/89/14/79/1045891479.db2.gz MRRFGIIZDQPIGG-ZDUSSCGKSA-N 1 1 334.313 4.144 20 5 EIBDMO CC1(C)C[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC[C@@H]1C(F)(F)F ZINC000792363086 1045891486 /nfs/dbraw/zinc/89/14/86/1045891486.db2.gz MRRFGIIZDQPIGG-ZDUSSCGKSA-N 1 1 334.313 4.144 20 5 EIBDMO OC[C@@H]1CC[N@@H+](Cc2c3ccccc3c(Cl)c3ccccc32)C1 ZINC000769238572 1045898664 /nfs/dbraw/zinc/89/86/64/1045898664.db2.gz DIQUMRQDQBNXKE-CQSZACIVSA-N 1 1 325.839 4.461 20 5 EIBDMO CO[C@@]1(C(F)(F)F)CCC[N@@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000614923777 1045944247 /nfs/dbraw/zinc/94/42/47/1045944247.db2.gz FQEZPOUUSOYVQN-DOMZBBRYSA-N 1 1 346.349 4.008 20 5 EIBDMO CO[C@@]1(C(F)(F)F)CCC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000614923777 1045944252 /nfs/dbraw/zinc/94/42/52/1045944252.db2.gz FQEZPOUUSOYVQN-DOMZBBRYSA-N 1 1 346.349 4.008 20 5 EIBDMO COc1ccc(C[C@@H](C)[N@@H+](C)CCCc2ccccc2)c([N+](=O)[O-])c1 ZINC001170346544 1046019617 /nfs/dbraw/zinc/01/96/17/1046019617.db2.gz OBOZIJUZLJTNKF-MRXNPFEDSA-N 1 1 342.439 4.099 20 5 EIBDMO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000792877902 1046089591 /nfs/dbraw/zinc/08/95/91/1046089591.db2.gz WXPJNDASGPCUPQ-HNNXBMFYSA-N 1 1 349.774 4.397 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+](CC2CC2)C2CCC2)ccc1Br ZINC000793396564 1046236129 /nfs/dbraw/zinc/23/61/29/1046236129.db2.gz RVJASKGLPUNLDV-UHFFFAOYSA-N 1 1 339.233 4.122 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc3ncccc3c2)C2CC2)cc1 ZINC000154259588 1046613168 /nfs/dbraw/zinc/61/31/68/1046613168.db2.gz ZDYKPACXMFXFLF-UHFFFAOYSA-N 1 1 333.391 4.308 20 5 EIBDMO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000536683522 1046684962 /nfs/dbraw/zinc/68/49/62/1046684962.db2.gz YFFFYFWXZUYPQQ-KRWDZBQOSA-N 1 1 326.396 4.249 20 5 EIBDMO CC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H](C)c1cccc(OC)c1 ZINC000917106165 1046719690 /nfs/dbraw/zinc/71/96/90/1046719690.db2.gz SBQJICYHBRSPTN-ZDUSSCGKSA-N 1 1 332.375 4.326 20 5 EIBDMO CC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H](C)c1cccc(OC)c1 ZINC000917106165 1046719699 /nfs/dbraw/zinc/71/96/99/1046719699.db2.gz SBQJICYHBRSPTN-ZDUSSCGKSA-N 1 1 332.375 4.326 20 5 EIBDMO Cc1c([C@@H](C)[NH2+][C@H]2COc3ccc(Cl)cc32)cccc1[N+](=O)[O-] ZINC000536850426 1046821480 /nfs/dbraw/zinc/82/14/80/1046821480.db2.gz GZQCPYBPWHDACH-ABAIWWIYSA-N 1 1 332.787 4.341 20 5 EIBDMO C[N@H+](Cc1cccc2ccccc21)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000917470519 1046909239 /nfs/dbraw/zinc/90/92/39/1046909239.db2.gz YMQDGMHCHPQYGN-UHFFFAOYSA-N 1 1 346.390 4.187 20 5 EIBDMO O=[N+]([O-])c1cc(Br)ccc1C[NH+]1CCC2(CCC2)CC1 ZINC001170075879 1047036134 /nfs/dbraw/zinc/03/61/34/1047036134.db2.gz WHLNMOADFWMGQI-UHFFFAOYSA-N 1 1 339.233 4.123 20 5 EIBDMO Cc1cc(N[C@H]2C[N@H+](C)Cc3ccccc32)c2cccc([N+](=O)[O-])c2n1 ZINC000537346803 1047137002 /nfs/dbraw/zinc/13/70/02/1047137002.db2.gz DDUJFDSOTBKONN-SFHVURJKSA-N 1 1 348.406 4.050 20 5 EIBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000788473354 1047198625 /nfs/dbraw/zinc/19/86/25/1047198625.db2.gz HRFASZSMVLLJMA-KRWDZBQOSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000788473354 1047198610 /nfs/dbraw/zinc/19/86/10/1047198610.db2.gz HRFASZSMVLLJMA-KRWDZBQOSA-N 1 1 330.359 4.080 20 5 EIBDMO C[C@@H]1C[C@H](c2ccccc2)[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC001170086827 1047244239 /nfs/dbraw/zinc/24/42/39/1047244239.db2.gz YGVYBKCNKCESCQ-CRAIPNDOSA-N 1 1 326.396 4.057 20 5 EIBDMO C[C@H](N[C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000556057309 1047420397 /nfs/dbraw/zinc/42/03/97/1047420397.db2.gz BDCLPSJVDWJVSO-QKYXUNIQSA-N 1 1 339.439 4.081 20 5 EIBDMO C[C@H](N[C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000556057309 1047420399 /nfs/dbraw/zinc/42/03/99/1047420399.db2.gz BDCLPSJVDWJVSO-QKYXUNIQSA-N 1 1 339.439 4.081 20 5 EIBDMO COc1ccccc1[C@@H]1CCCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000609281041 1047476565 /nfs/dbraw/zinc/47/65/65/1047476565.db2.gz ZIJXZCGZIZJAQO-SFHVURJKSA-N 1 1 326.396 4.331 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](c3ccccc3F)C2)c(Cl)c1 ZINC001170536057 1047517380 /nfs/dbraw/zinc/51/73/80/1047517380.db2.gz KFKKZPHJEKGLRN-GFCCVEGCSA-N 1 1 334.778 4.377 20 5 EIBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000609287794 1047689637 /nfs/dbraw/zinc/68/96/37/1047689637.db2.gz TZORYKWSTOCCGY-LBPRGKRZSA-N 1 1 343.349 4.042 20 5 EIBDMO CC(C)([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)c1ccccc1[N+](=O)[O-] ZINC000814178291 1047868314 /nfs/dbraw/zinc/86/83/14/1047868314.db2.gz KWRHSWWGXFOXRH-UHFFFAOYSA-N 1 1 349.774 4.181 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)cc1F ZINC000814667514 1048121809 /nfs/dbraw/zinc/12/18/09/1048121809.db2.gz RYMVBBCXXPDTJM-CQSZACIVSA-N 1 1 334.778 4.377 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1C ZINC001171134448 1048413243 /nfs/dbraw/zinc/41/32/43/1048413243.db2.gz YZTPIYIFPABTDA-GOSISDBHSA-N 1 1 344.386 4.388 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1c1ccc(F)cc1C ZINC001171134448 1048413250 /nfs/dbraw/zinc/41/32/50/1048413250.db2.gz YZTPIYIFPABTDA-GOSISDBHSA-N 1 1 344.386 4.388 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1C ZINC001171134449 1048414435 /nfs/dbraw/zinc/41/44/35/1048414435.db2.gz YZTPIYIFPABTDA-SFHVURJKSA-N 1 1 344.386 4.388 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1c1ccc(F)cc1C ZINC001171134449 1048414443 /nfs/dbraw/zinc/41/44/43/1048414443.db2.gz YZTPIYIFPABTDA-SFHVURJKSA-N 1 1 344.386 4.388 20 5 EIBDMO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccncc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815565823 1048512196 /nfs/dbraw/zinc/51/21/96/1048512196.db2.gz BEQRFFGYPOEBML-XOBRGWDASA-N 1 1 348.406 4.012 20 5 EIBDMO C[C@@H]([NH2+]Cc1cccc(Cl)c1Cl)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815572306 1048534552 /nfs/dbraw/zinc/53/45/52/1048534552.db2.gz ZSARXUFAKVGWGH-SECBINFHSA-N 1 1 340.210 4.335 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](Oc2ccc(Cl)cc2)C1 ZINC001170594246 1048584328 /nfs/dbraw/zinc/58/43/28/1048584328.db2.gz RZVSYCIPXREJKA-CJNGLKHVSA-N 1 1 346.814 4.463 20 5 EIBDMO CO[C@@]1(C)CCC[N@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000809999242 1048599876 /nfs/dbraw/zinc/59/98/76/1048599876.db2.gz DLOOJLNXZWOEHH-HNNXBMFYSA-N 1 1 347.242 4.293 20 5 EIBDMO CO[C@@]1(C)CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000809999242 1048599890 /nfs/dbraw/zinc/59/98/90/1048599890.db2.gz DLOOJLNXZWOEHH-HNNXBMFYSA-N 1 1 347.242 4.293 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@]4(CC4(F)F)C3)o2)c1 ZINC000846106405 1048823277 /nfs/dbraw/zinc/82/32/77/1048823277.db2.gz AZJRBIVDCZBXDX-KRWDZBQOSA-N 1 1 348.349 4.476 20 5 EIBDMO CC(C)[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H](C)c1ccsc1 ZINC000817287202 1048925743 /nfs/dbraw/zinc/92/57/43/1048925743.db2.gz LFQJWKXIADKCJD-CXAGYDPISA-N 1 1 334.441 4.161 20 5 EIBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H](C)Cc1ccc(OC)cc1 ZINC000609432105 1049061586 /nfs/dbraw/zinc/06/15/86/1049061586.db2.gz CJUHQCUFDFGFLF-OAHLLOKOSA-N 1 1 328.412 4.057 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000609705059 1049279155 /nfs/dbraw/zinc/27/91/55/1049279155.db2.gz LSTRLBCTKZTGBW-GOSISDBHSA-N 1 1 346.814 4.212 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000609705059 1049279178 /nfs/dbraw/zinc/27/91/78/1049279178.db2.gz LSTRLBCTKZTGBW-GOSISDBHSA-N 1 1 346.814 4.212 20 5 EIBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)cc1 ZINC000609705149 1049279619 /nfs/dbraw/zinc/27/96/19/1049279619.db2.gz VLDGZCZYSXEPKA-CQSZACIVSA-N 1 1 346.814 4.246 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000609800731 1049328003 /nfs/dbraw/zinc/32/80/03/1049328003.db2.gz RFBZKFAYRVANDB-KBXCAEBGSA-N 1 1 328.437 4.446 20 5 EIBDMO C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000609916159 1049397443 /nfs/dbraw/zinc/39/74/43/1049397443.db2.gz BMQUZKWSBIGQRI-TZMCWYRMSA-N 1 1 332.350 4.251 20 5 EIBDMO Cc1ccccc1[C@H]1C[C@@H](C)[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000610001876 1049467746 /nfs/dbraw/zinc/46/77/46/1049467746.db2.gz JKFCKLTXDCFMEE-CABCVRRESA-N 1 1 328.387 4.420 20 5 EIBDMO CC1(C)CCC[C@@H]1[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC001171457720 1049711007 /nfs/dbraw/zinc/71/10/07/1049711007.db2.gz LNWRKSWCRIJRMM-CZUORRHYSA-N 1 1 347.415 4.151 20 5 EIBDMO CC1(C)CCC[C@H]1[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC001171457719 1049712341 /nfs/dbraw/zinc/71/23/41/1049712341.db2.gz LNWRKSWCRIJRMM-CJNGLKHVSA-N 1 1 347.415 4.151 20 5 EIBDMO CC1(C)CCC[C@@H]1[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC001171457722 1049713066 /nfs/dbraw/zinc/71/30/66/1049713066.db2.gz LNWRKSWCRIJRMM-XJKSGUPXSA-N 1 1 347.415 4.151 20 5 EIBDMO Cc1cccc(C2([NH2+]Cc3c(F)cc([N+](=O)[O-])cc3F)CCC2)c1 ZINC001171501807 1049738406 /nfs/dbraw/zinc/73/84/06/1049738406.db2.gz MHFUGPJELDWTMH-UHFFFAOYSA-N 1 1 332.350 4.350 20 5 EIBDMO C[C@H]1CC[N@@H+](Cc2c3ccccc3cc3ccccc32)CC[S@@]1=O ZINC000763490238 1050062324 /nfs/dbraw/zinc/06/23/24/1050062324.db2.gz KFRMGTMUXIEJEE-FYSMJZIKSA-N 1 1 337.488 4.336 20 5 EIBDMO C[N@@H+](Cc1ccc(F)cc1F)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172919613 1050233487 /nfs/dbraw/zinc/23/34/87/1050233487.db2.gz GUWRUNUGXQZYSE-QGZVFWFLSA-N 1 1 346.377 4.252 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCC[C@H](C(F)(F)F)C1)CC2 ZINC001172910877 1050244749 /nfs/dbraw/zinc/24/47/49/1050244749.db2.gz PRKKOEIEGDOPBD-LSDHHAIUSA-N 1 1 342.361 4.117 20 5 EIBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)Cc2ccc(C)cc2)c1F ZINC001173190493 1050338359 /nfs/dbraw/zinc/33/83/59/1050338359.db2.gz UADNMDGEZYODCB-CQSZACIVSA-N 1 1 346.402 4.114 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@H]1c1cccnc1 ZINC001173227234 1050357824 /nfs/dbraw/zinc/35/78/24/1050357824.db2.gz OTLVNJPEHGXREI-KXBFYZLASA-N 1 1 325.412 4.148 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCc1cccc(Cl)c1 ZINC001173233278 1050358764 /nfs/dbraw/zinc/35/87/64/1050358764.db2.gz KFRLZXKSWGXOQU-AWEZNQCLSA-N 1 1 332.831 4.354 20 5 EIBDMO CC(C)[N@@H+](CC(=O)c1ccccc1)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173232827 1050359231 /nfs/dbraw/zinc/35/92/31/1050359231.db2.gz IENKMQVMYLLJNY-INIZCTEOSA-N 1 1 340.423 4.119 20 5 EIBDMO COc1ccc([C@H]2CC[N@H+]([C@@H](C)Cc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC001173230757 1050360002 /nfs/dbraw/zinc/36/00/02/1050360002.db2.gz FLLMWHYCTNXUBO-YJBOKZPZSA-N 1 1 340.423 4.024 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCc1ccc(Cl)cc1 ZINC001173235713 1050362458 /nfs/dbraw/zinc/36/24/58/1050362458.db2.gz YTVWIIRGFACHKY-AWEZNQCLSA-N 1 1 332.831 4.354 20 5 EIBDMO Cc1ccc([C@@H]2CCC[N@@H+]2[C@H](C)Cc2ccc([N+](=O)[O-])cc2)cn1 ZINC001173233701 1050362799 /nfs/dbraw/zinc/36/27/99/1050362799.db2.gz MFDZYYDBVZFRPO-BEFAXECRSA-N 1 1 325.412 4.066 20 5 EIBDMO COc1ccccc1C(C)(C)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000182332653 1050611251 /nfs/dbraw/zinc/61/12/51/1050611251.db2.gz NQCWIVSZMPGNTA-UHFFFAOYSA-N 1 1 334.803 4.282 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCc2cccc(Cl)c2)C2CC2)c1 ZINC001179913939 1050833910 /nfs/dbraw/zinc/83/39/10/1050833910.db2.gz NSPGNBKCCFFUHB-UHFFFAOYSA-N 1 1 330.815 4.455 20 5 EIBDMO COc1c(O)ccc(C[N@@H+]2CCCC[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC001180585460 1051044643 /nfs/dbraw/zinc/04/46/43/1051044643.db2.gz MORWEECBAJSKCF-MRXNPFEDSA-N 1 1 342.395 4.036 20 5 EIBDMO COc1c(O)ccc(C[N@H+]2CCCC[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC001180585460 1051044648 /nfs/dbraw/zinc/04/46/48/1051044648.db2.gz MORWEECBAJSKCF-MRXNPFEDSA-N 1 1 342.395 4.036 20 5 EIBDMO C[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000183707246 1051308193 /nfs/dbraw/zinc/30/81/93/1051308193.db2.gz LEAVNZGCAPBSIH-CQSZACIVSA-N 1 1 337.379 4.443 20 5 EIBDMO C[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000183712532 1051309952 /nfs/dbraw/zinc/30/99/52/1051309952.db2.gz IVILMAPLDMAIQS-AWEZNQCLSA-N 1 1 337.379 4.443 20 5 EIBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC001191047482 1051347947 /nfs/dbraw/zinc/34/79/47/1051347947.db2.gz FWTFWSLSCFBJCQ-HNNXBMFYSA-N 1 1 346.814 4.117 20 5 EIBDMO Cc1ccc(C[C@@H](C)[N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC001191123472 1051359132 /nfs/dbraw/zinc/35/91/32/1051359132.db2.gz WAVDLQBRNWQTMQ-QGZVFWFLSA-N 1 1 342.439 4.235 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC001181986882 1051364511 /nfs/dbraw/zinc/36/45/11/1051364511.db2.gz PCWYHUVJHPSVKX-HNNXBMFYSA-N 1 1 328.387 4.340 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCS[C@H]3CCCC[C@H]32)c(Cl)c1 ZINC001191359318 1051441184 /nfs/dbraw/zinc/44/11/84/1051441184.db2.gz UNZRQPIFMHJUOB-CABCVRRESA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCS[C@H]3CCCC[C@H]32)c(Cl)c1 ZINC001191359318 1051441193 /nfs/dbraw/zinc/44/11/93/1051441193.db2.gz UNZRQPIFMHJUOB-CABCVRRESA-N 1 1 326.849 4.108 20 5 EIBDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)C1(CC)CC ZINC001191822680 1051561890 /nfs/dbraw/zinc/56/18/90/1051561890.db2.gz YAYIOGAYBOULTI-DLBZAZTESA-N 1 1 338.423 4.150 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@H]2CCCC3(CCC3)O2)C2CC2)cc1 ZINC001192939419 1051842011 /nfs/dbraw/zinc/84/20/11/1051842011.db2.gz MWUUBGMKBWYAJP-GOSISDBHSA-N 1 1 330.428 4.051 20 5 EIBDMO C[C@H]1C[C@@H](c2ccccc2)[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC001194153149 1052088867 /nfs/dbraw/zinc/08/88/67/1052088867.db2.gz MPCYCBAVWFORTL-SGTLLEGYSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@H]1C[C@@H](c2ccccc2)[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC001194153149 1052088881 /nfs/dbraw/zinc/08/88/81/1052088881.db2.gz MPCYCBAVWFORTL-SGTLLEGYSA-N 1 1 332.350 4.456 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1NCCC[N@H+]1CCc2ccccc2C1 ZINC001184819678 1052111517 /nfs/dbraw/zinc/11/15/17/1052111517.db2.gz FLQXJBWIUSDNED-UHFFFAOYSA-N 1 1 345.830 4.109 20 5 EIBDMO CC[C@@H](C)[C@@H](C)[N@@H+]1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC001194291471 1052128768 /nfs/dbraw/zinc/12/87/68/1052128768.db2.gz OVNPKYOWMATUPV-GHMZBOCLSA-N 1 1 341.249 4.150 20 5 EIBDMO CC[C@@H](C)[C@@H](C)[N@H+]1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC001194291471 1052128775 /nfs/dbraw/zinc/12/87/75/1052128775.db2.gz OVNPKYOWMATUPV-GHMZBOCLSA-N 1 1 341.249 4.150 20 5 EIBDMO O=[N+]([O-])c1cccc2c1CCN(c1cc[nH+]c3ccc(Cl)cc31)C2 ZINC000864012103 1053136546 /nfs/dbraw/zinc/13/65/46/1053136546.db2.gz QXLADBRNWHOIDH-UHFFFAOYSA-N 1 1 339.782 4.359 20 5 EIBDMO C[N@H+](Cc1csc([N+](=O)[O-])c1)[C@H]1C[C@@H](Oc2ccccc2)C1(C)C ZINC001194881566 1053143549 /nfs/dbraw/zinc/14/35/49/1053143549.db2.gz ALVIRISBXTUKQK-JKSUJKDBSA-N 1 1 346.452 4.334 20 5 EIBDMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@H]1C[C@@H](Oc2ccccc2)C1(C)C ZINC001194881566 1053143596 /nfs/dbraw/zinc/14/35/96/1053143596.db2.gz ALVIRISBXTUKQK-JKSUJKDBSA-N 1 1 346.452 4.334 20 5 EIBDMO CC(C)[C@H](O)[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 ZINC000850394966 1053162785 /nfs/dbraw/zinc/16/27/85/1053162785.db2.gz KEZZEHCSVPIWFF-ROUUACIJSA-N 1 1 348.830 4.096 20 5 EIBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1CCCC[C@@H]1c1ccccc1 ZINC001195156720 1053308125 /nfs/dbraw/zinc/30/81/25/1053308125.db2.gz ZORVMXAICLARRW-MSOLQXFVSA-N 1 1 325.412 4.148 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCc2ccc(C(C)C)cc2C1 ZINC001195911810 1053525676 /nfs/dbraw/zinc/52/56/76/1053525676.db2.gz RKHLKPOIDIXJEG-UHFFFAOYSA-N 1 1 340.423 4.285 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCc2ccc(C(C)C)cc2C1 ZINC001195911810 1053525690 /nfs/dbraw/zinc/52/56/90/1053525690.db2.gz RKHLKPOIDIXJEG-UHFFFAOYSA-N 1 1 340.423 4.285 20 5 EIBDMO CCC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCc2ccccc21 ZINC000776580319 1053563238 /nfs/dbraw/zinc/56/32/38/1053563238.db2.gz UFFHYEVLTUOMBX-PMACEKPBSA-N 1 1 340.423 4.028 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]([C@H]3CCCCO3)C2)ccc1Cl ZINC000852595548 1053593718 /nfs/dbraw/zinc/59/37/18/1053593718.db2.gz IGDIZJNUDQEIIM-RHSMWYFYSA-N 1 1 338.835 4.029 20 5 EIBDMO C[N@H+]1CCC[C@H](CNc2ccccc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000301409063 1053870897 /nfs/dbraw/zinc/87/08/97/1053870897.db2.gz IYWFWXVVBBBEIJ-CXAGYDPISA-N 1 1 331.441 4.151 20 5 EIBDMO C[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccc2ncsc2c1 ZINC000776818794 1053946828 /nfs/dbraw/zinc/94/68/28/1053946828.db2.gz MQHBKKCTHMYSKI-JTQLQIEISA-N 1 1 331.372 4.194 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](C)[C@@H]1c1ccccc1 ZINC001197661365 1053961368 /nfs/dbraw/zinc/96/13/68/1053961368.db2.gz UTKLFGQQKTXJRP-AUUYWEPGSA-N 1 1 326.396 4.187 20 5 EIBDMO C[C@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC001197658223 1053962239 /nfs/dbraw/zinc/96/22/39/1053962239.db2.gz DXHLFUWIKWMQOO-HNAYVOBHSA-N 1 1 326.396 4.057 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@@H]2[C@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC001198010202 1054046098 /nfs/dbraw/zinc/04/60/98/1054046098.db2.gz FSYOHCVUIMZTHZ-CRAIPNDOSA-N 1 1 340.423 4.372 20 5 EIBDMO C[C@H]([NH2+][C@H](c1ccccc1)[C@H]1CCCO1)c1c(F)cccc1[N+](=O)[O-] ZINC000872026927 1054343587 /nfs/dbraw/zinc/34/35/87/1054343587.db2.gz AAAOHGICLUMYIN-BOFPYLFWSA-N 1 1 344.386 4.305 20 5 EIBDMO C[C@H]([NH2+][C@@H](c1ccccc1)[C@H]1CCCO1)c1c(F)cccc1[N+](=O)[O-] ZINC000872026928 1054344077 /nfs/dbraw/zinc/34/40/77/1054344077.db2.gz AAAOHGICLUMYIN-IRWQIABSSA-N 1 1 344.386 4.305 20 5 EIBDMO Cc1cccnc1[C@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])C(C)C ZINC000872034138 1054349182 /nfs/dbraw/zinc/34/91/82/1054349182.db2.gz IBBVMSWCNKLNDD-SUMWQHHRSA-N 1 1 331.391 4.485 20 5 EIBDMO CCN(C)c1ccccc1C[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872033760 1054350473 /nfs/dbraw/zinc/35/04/73/1054350473.db2.gz JEHBBZXYHZVPGW-ZDUSSCGKSA-N 1 1 331.391 4.041 20 5 EIBDMO COC[C@@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1SC)c1ccccc1 ZINC000872044852 1054358657 /nfs/dbraw/zinc/35/86/57/1054358657.db2.gz GFONPUSJXBCJGH-SUMWQHHRSA-N 1 1 346.452 4.355 20 5 EIBDMO COC[C@@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1SC)c1ccccc1 ZINC000872044849 1054359657 /nfs/dbraw/zinc/35/96/57/1054359657.db2.gz GFONPUSJXBCJGH-CXAGYDPISA-N 1 1 346.452 4.355 20 5 EIBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000872046812 1054359797 /nfs/dbraw/zinc/35/97/97/1054359797.db2.gz LZZYTNYWCIFCSS-NSHDSACASA-N 1 1 347.396 4.076 20 5 EIBDMO C[C@H](N[C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872060562 1054369788 /nfs/dbraw/zinc/36/97/88/1054369788.db2.gz RAVAHPHTKNTQMY-KKUMJFAQSA-N 1 1 349.450 4.038 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1csc(-c2ccco2)n1 ZINC001201017873 1054610436 /nfs/dbraw/zinc/61/04/36/1054610436.db2.gz YWDUTRQGIWPGSY-UHFFFAOYSA-N 1 1 343.408 4.218 20 5 EIBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)Nc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000301507805 1055648451 /nfs/dbraw/zinc/64/84/51/1055648451.db2.gz AHJHHIFHNBQYAW-GFCCVEGCSA-N 1 1 340.358 4.401 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1Nc1cccc(F)c1[N+](=O)[O-] ZINC000301588417 1055741503 /nfs/dbraw/zinc/74/15/03/1055741503.db2.gz PUUBGFJKUXNFAZ-RHSMWYFYSA-N 1 1 343.402 4.056 20 5 EIBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273409120 1055802226 /nfs/dbraw/zinc/80/22/26/1055802226.db2.gz HZWNMMWWHFWJDQ-IEBWSBKVSA-N 1 1 344.386 4.086 20 5 EIBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273409125 1055802981 /nfs/dbraw/zinc/80/29/81/1055802981.db2.gz HZWNMMWWHFWJDQ-PKOBYXMFSA-N 1 1 344.386 4.086 20 5 EIBDMO CCC[N@H+](C)Cc1nc(-c2c3ccccc3nc3ccccc32)no1 ZINC000624747619 1055999992 /nfs/dbraw/zinc/99/99/92/1055999992.db2.gz BPGZTTKIPJUTQM-UHFFFAOYSA-N 1 1 332.407 4.280 20 5 EIBDMO CCC[N@@H+](C)Cc1nc(-c2c3ccccc3nc3ccccc32)no1 ZINC000624747619 1056000003 /nfs/dbraw/zinc/00/00/03/1056000003.db2.gz BPGZTTKIPJUTQM-UHFFFAOYSA-N 1 1 332.407 4.280 20 5 EIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](C)C(C)(C)C1 ZINC000273705711 1056089464 /nfs/dbraw/zinc/08/94/64/1056089464.db2.gz NKYVNZOFKRNXKV-STQMWFEESA-N 1 1 344.415 4.074 20 5 EIBDMO C[N@@H+](CCCNc1ccc([N+](=O)[O-])c2cnccc12)C1CCCCC1 ZINC000327346516 1056687055 /nfs/dbraw/zinc/68/70/55/1056687055.db2.gz CUKKFJYKYRQBFR-UHFFFAOYSA-N 1 1 342.443 4.210 20 5 EIBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H](O)c1cccc(Cl)c1 ZINC000743263256 1058907930 /nfs/dbraw/zinc/90/79/30/1058907930.db2.gz AHBWKJNKGKRYGK-GOSISDBHSA-N 1 1 348.830 4.192 20 5 EIBDMO Cc1ccc([C@@H]2CC[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC001169198448 1060682836 /nfs/dbraw/zinc/68/28/36/1060682836.db2.gz XSWIHUORGAHDMZ-GOSISDBHSA-N 1 1 340.423 4.162 20 5 EIBDMO C[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC001169282478 1060740232 /nfs/dbraw/zinc/74/02/32/1060740232.db2.gz DFOWQIDSPKFLLZ-FZMZJTMJSA-N 1 1 341.249 4.368 20 5 EIBDMO COc1ccc(C)cc1C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000532275869 1032130354 /nfs/dbraw/zinc/13/03/54/1032130354.db2.gz NKDYQCVSYZWWIB-UHFFFAOYSA-N 1 1 326.396 4.076 20 5 EIBDMO COc1ccc(C)cc1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000532275869 1032130359 /nfs/dbraw/zinc/13/03/59/1032130359.db2.gz NKDYQCVSYZWWIB-UHFFFAOYSA-N 1 1 326.396 4.076 20 5 EIBDMO CC(C)[C@@H]1CCCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000532974655 1032432275 /nfs/dbraw/zinc/43/22/75/1032432275.db2.gz UMLXNSPYNMBNKF-KRWDZBQOSA-N 1 1 343.427 4.303 20 5 EIBDMO O=[N+]([O-])c1cccc(C[NH+]2CCC(Oc3ccccc3Cl)CC2)c1 ZINC000533148048 1032516841 /nfs/dbraw/zinc/51/68/41/1032516841.db2.gz NCAYQKDPZASXHB-UHFFFAOYSA-N 1 1 346.814 4.292 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@@H](C(F)(F)F)C3(CCC3)C2)c1 ZINC000579855808 1019677090 /nfs/dbraw/zinc/67/70/90/1019677090.db2.gz GCTHDVMTSFULDT-CQSZACIVSA-N 1 1 328.334 4.149 20 5 EIBDMO CC(C)C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)CC(C)(C)C ZINC000134449959 1019813342 /nfs/dbraw/zinc/81/33/42/1019813342.db2.gz RJHDVALFFNEQLV-UHFFFAOYSA-N 1 1 346.431 4.149 20 5 EIBDMO CCC[N@@H+](CC1CCCCC1)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC001167146131 1020368755 /nfs/dbraw/zinc/36/87/55/1020368755.db2.gz KZVKDWRHCHEGJI-OAHLLOKOSA-N 1 1 347.459 4.214 20 5 EIBDMO C[C@@H]1C[C@H](c2ccccc2)C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083174493 1021015957 /nfs/dbraw/zinc/01/59/57/1021015957.db2.gz ZOKXURXRZPMCKJ-HIFRSBDPSA-N 1 1 337.379 4.114 20 5 EIBDMO C[C@H](C1CC1)[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CC1 ZINC000549366784 1022087762 /nfs/dbraw/zinc/08/77/62/1022087762.db2.gz PZXXJLOGTAUZRA-SNVBAGLBSA-N 1 1 328.334 4.377 20 5 EIBDMO C[C@@H]1CC2(CCC2)C[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000432798703 1022207449 /nfs/dbraw/zinc/20/74/49/1022207449.db2.gz RHRXVXMWEUYFIX-CYBMUJFWSA-N 1 1 343.452 4.483 20 5 EIBDMO Cc1c(C[NH+]2CCC(C(=O)c3cccs3)CC2)cccc1[N+](=O)[O-] ZINC000365781287 1022759706 /nfs/dbraw/zinc/75/97/06/1022759706.db2.gz CNZJLUIKKUJEBH-UHFFFAOYSA-N 1 1 344.436 4.060 20 5 EIBDMO C[N@H+](Cc1csc(Br)c1)Cc1ccc([N+](=O)[O-])cc1 ZINC000053359527 1023425182 /nfs/dbraw/zinc/42/51/82/1023425182.db2.gz USPLVEXQMUJVGB-UHFFFAOYSA-N 1 1 341.230 4.051 20 5 EIBDMO C[N@@H+](Cc1csc(Br)c1)Cc1ccc([N+](=O)[O-])cc1 ZINC000053359527 1023425192 /nfs/dbraw/zinc/42/51/92/1023425192.db2.gz USPLVEXQMUJVGB-UHFFFAOYSA-N 1 1 341.230 4.051 20 5 EIBDMO Cc1c(C[N@@H+](C)Cc2ccccc2N2CCCC2)cccc1[N+](=O)[O-] ZINC000051120078 1023447108 /nfs/dbraw/zinc/44/71/08/1023447108.db2.gz IAINMXSZYBGDEL-UHFFFAOYSA-N 1 1 339.439 4.135 20 5 EIBDMO CCC[N@@H+](CCc1cccc(F)c1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000500184359 1023576618 /nfs/dbraw/zinc/57/66/18/1023576618.db2.gz OFZKAZUFJIKHBX-UHFFFAOYSA-N 1 1 346.402 4.197 20 5 EIBDMO Cc1ccc2c(ccnc2NCCC[N@@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC001167751720 1023622143 /nfs/dbraw/zinc/62/21/43/1023622143.db2.gz NTNMCYJCURZPDF-HNNXBMFYSA-N 1 1 342.443 4.128 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC001167764945 1023853059 /nfs/dbraw/zinc/85/30/59/1023853059.db2.gz CDNACDQUOWMFID-KRWDZBQOSA-N 1 1 345.830 4.325 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC001167764945 1023853060 /nfs/dbraw/zinc/85/30/60/1023853060.db2.gz CDNACDQUOWMFID-KRWDZBQOSA-N 1 1 345.830 4.325 20 5 EIBDMO C[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)[C@@H]2CCCC[C@H]12 ZINC000610581895 1024134314 /nfs/dbraw/zinc/13/43/14/1024134314.db2.gz XNMCFCNGYKLFRP-XNRPHZJLSA-N 1 1 329.400 4.137 20 5 EIBDMO CC[NH+](CC)CCCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000549560661 1024365207 /nfs/dbraw/zinc/36/52/07/1024365207.db2.gz OUDXQIGAUCUZMS-UHFFFAOYSA-N 1 1 347.484 4.145 20 5 EIBDMO Cn1cccc1[C@@H]1CCCC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000538725520 1025512354 /nfs/dbraw/zinc/51/23/54/1025512354.db2.gz ZYAXRUDODSWLFB-QBUQCISBSA-N 1 1 325.412 4.174 20 5 EIBDMO C[N@H+]1CC[C@@H](Nc2ccnc3c2cccc3[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000432334815 1025644073 /nfs/dbraw/zinc/64/40/73/1025644073.db2.gz KMEAXGYKCRHSSF-XLIONFOSSA-N 1 1 348.406 4.000 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N(C)C ZINC000472080532 1025696515 /nfs/dbraw/zinc/69/65/15/1025696515.db2.gz PZRVMSODWXCACF-FZKQIMNGSA-N 1 1 347.846 4.029 20 5 EIBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)Cc1cccnc1 ZINC000182034876 1025882547 /nfs/dbraw/zinc/88/25/47/1025882547.db2.gz HNOIJYAWIFLRCZ-UHFFFAOYSA-N 1 1 339.420 4.350 20 5 EIBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2cccc([N+](=O)[O-])c2)C12CCCCC2 ZINC001167535353 1025977144 /nfs/dbraw/zinc/97/71/44/1025977144.db2.gz VGHVNPDQFUZIKA-QZTJIDSGSA-N 1 1 332.444 4.155 20 5 EIBDMO CC1(C)C[C@H]([NH2+]Cc2ccc(Cl)cn2)c2cc([N+](=O)[O-])ccc21 ZINC000279036650 1025993846 /nfs/dbraw/zinc/99/38/46/1025993846.db2.gz JAYUHGWAFLXADG-INIZCTEOSA-N 1 1 331.803 4.155 20 5 EIBDMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC001167543910 1026041088 /nfs/dbraw/zinc/04/10/88/1026041088.db2.gz GOHSMZKVJJCTDI-CQSZACIVSA-N 1 1 341.249 4.368 20 5 EIBDMO CCCC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC001167553686 1026297964 /nfs/dbraw/zinc/29/79/64/1026297964.db2.gz HWDMFLRDAGOFDW-UHFFFAOYSA-N 1 1 341.249 4.369 20 5 EIBDMO COCCc1cc[nH+]c(N[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)c1 ZINC000582232969 1026356017 /nfs/dbraw/zinc/35/60/17/1026356017.db2.gz VLMQGDPTJWQYIX-KRWDZBQOSA-N 1 1 341.411 4.013 20 5 EIBDMO CC[C@@H]([NH2+][C@@H](C)c1nc2c(s1)CCC2)c1cccc([N+](=O)[O-])c1 ZINC000135062996 1026541861 /nfs/dbraw/zinc/54/18/61/1026541861.db2.gz IYAAEZJSCIDAFE-SMDDNHRTSA-N 1 1 331.441 4.342 20 5 EIBDMO COc1ccc2c(c1)CCC[C@@H]2[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000507140505 1026658305 /nfs/dbraw/zinc/65/83/05/1026658305.db2.gz DWEKCXILDUCPDL-IBGZPJMESA-N 1 1 326.396 4.113 20 5 EIBDMO COc1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c2ccccc12 ZINC000507158789 1026669572 /nfs/dbraw/zinc/66/95/72/1026669572.db2.gz FVPDIBQILSRHCC-UHFFFAOYSA-N 1 1 336.391 4.389 20 5 EIBDMO COCc1cccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000507152746 1026672933 /nfs/dbraw/zinc/67/29/33/1026672933.db2.gz YWSMVEQGYIBTRC-UHFFFAOYSA-N 1 1 328.412 4.152 20 5 EIBDMO CC(C)[C@@H]1CCC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000507190407 1026695290 /nfs/dbraw/zinc/69/52/90/1026695290.db2.gz ZFUWZQOFGVBCTF-INIZCTEOSA-N 1 1 331.441 4.339 20 5 EIBDMO CC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)[C@@H](C)c1cccc(OC)c1 ZINC000507700780 1026879373 /nfs/dbraw/zinc/87/93/73/1026879373.db2.gz MFISUHUSFFNDQI-HNNXBMFYSA-N 1 1 344.411 4.065 20 5 EIBDMO C[C@@H](Nc1ccc([N+](=O)[O-])cc1F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310795435 1027405205 /nfs/dbraw/zinc/40/52/05/1027405205.db2.gz FMJFBTAOYQTWLC-GDBMZVCRSA-N 1 1 343.402 4.056 20 5 EIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H](C)CC(C)(C)C1 ZINC000612134823 1027433330 /nfs/dbraw/zinc/43/33/30/1027433330.db2.gz CWRGZEWZOJFCJU-QWHCGFSZSA-N 1 1 344.415 4.074 20 5 EIBDMO CC[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000444675375 1027956410 /nfs/dbraw/zinc/95/64/10/1027956410.db2.gz LWGOMLJRJCYQEH-CZUORRHYSA-N 1 1 344.415 4.045 20 5 EIBDMO C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCc2ccccc2C1 ZINC000522558079 1028005267 /nfs/dbraw/zinc/00/52/67/1028005267.db2.gz UMJGRKVCYHQPDB-QGZVFWFLSA-N 1 1 330.815 4.238 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000441451538 1028008921 /nfs/dbraw/zinc/00/89/21/1028008921.db2.gz NPMZTLRWGBFLDG-MRXNPFEDSA-N 1 1 338.835 4.172 20 5 EIBDMO Cc1nc2ccc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])cc2s1 ZINC000583408493 1028670900 /nfs/dbraw/zinc/67/09/00/1028670900.db2.gz ZVOGWYMODXXUMJ-UHFFFAOYSA-N 1 1 341.436 4.187 20 5 EIBDMO COc1ccc(-c2ccc(CNc3cccc(C)[nH+]3)o2)c([N+](=O)[O-])c1 ZINC000343446633 1029266134 /nfs/dbraw/zinc/26/61/34/1029266134.db2.gz JZZXLFFERPLYIG-UHFFFAOYSA-N 1 1 339.351 4.179 20 5 EIBDMO C[C@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000523008761 1029365962 /nfs/dbraw/zinc/36/59/62/1029365962.db2.gz BGWWIUVELLLCKN-WMLDXEAASA-N 1 1 328.387 4.154 20 5 EIBDMO C[C@@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1(C)C ZINC000545416256 1029663721 /nfs/dbraw/zinc/66/37/21/1029663721.db2.gz HYKVSDZEDSPSAN-CYBMUJFWSA-N 1 1 329.400 4.118 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(OCC3CC3)cc2)c(Cl)c1 ZINC000480264774 1029802397 /nfs/dbraw/zinc/80/23/97/1029802397.db2.gz YIINROZTNTWYGP-UHFFFAOYSA-N 1 1 346.814 4.327 20 5 EIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@H](c2ccncc2)C1 ZINC000451006863 1030174871 /nfs/dbraw/zinc/17/48/71/1030174871.db2.gz SJEUVWYFMSMGCQ-AWEZNQCLSA-N 1 1 331.803 4.023 20 5 EIBDMO Cc1nc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c(C)s1 ZINC000451543421 1030563649 /nfs/dbraw/zinc/56/36/49/1030563649.db2.gz BLPOURDSEIPEEI-HNNXBMFYSA-N 1 1 331.441 4.048 20 5 EIBDMO CCCc1nc(C)c(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000451554469 1030572739 /nfs/dbraw/zinc/57/27/39/1030572739.db2.gz ZVYQAZVAEVYISY-MRXNPFEDSA-N 1 1 343.427 4.223 20 5 EIBDMO CC(C)C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCCC1 ZINC000520173759 1031325147 /nfs/dbraw/zinc/32/51/47/1031325147.db2.gz ZYDLGGBKRVQYTC-UHFFFAOYSA-N 1 1 344.415 4.045 20 5 EIBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H](C)Cc1ccc(OC)cc1 ZINC000520194988 1031399198 /nfs/dbraw/zinc/39/91/98/1031399198.db2.gz OMZVMQJFSJJTSO-HNNXBMFYSA-N 1 1 342.439 4.365 20 5 EIBDMO Cc1c(C[NH2+][C@H]2CCc3cc(F)c(F)c(F)c32)cccc1[N+](=O)[O-] ZINC000449278889 1031591947 /nfs/dbraw/zinc/59/19/47/1031591947.db2.gz MSNPFGZIIMFZGO-ZDUSSCGKSA-N 1 1 336.313 4.098 20 5 EIBDMO C[C@H](N[C@@H]1CC[N@H+](C)[C@@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000453222234 1031740799 /nfs/dbraw/zinc/74/07/99/1031740799.db2.gz KZGMSUQFIUJAQE-QKYXUNIQSA-N 1 1 339.439 4.081 20 5 EIBDMO C[C@H](N[C@@H]1CC[N@@H+](C)[C@@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000453222234 1031740805 /nfs/dbraw/zinc/74/08/05/1031740805.db2.gz KZGMSUQFIUJAQE-QKYXUNIQSA-N 1 1 339.439 4.081 20 5 EIBDMO C[C@@H]1CCCC[N@@H+]1CCC1CCN(Cc2ccccc2[N+](=O)[O-])CC1 ZINC000531909984 1031806611 /nfs/dbraw/zinc/80/66/11/1031806611.db2.gz CWLOHXOILHMNFD-QGZVFWFLSA-N 1 1 345.487 4.071 20 5 EIBDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(Cc2ccccc2[N+](=O)[O-])CC1 ZINC000531909984 1031806616 /nfs/dbraw/zinc/80/66/16/1031806616.db2.gz CWLOHXOILHMNFD-QGZVFWFLSA-N 1 1 345.487 4.071 20 5 EIBDMO C[C@@H]1CCCC[N@@H+]1CCC1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000531910557 1031807282 /nfs/dbraw/zinc/80/72/82/1031807282.db2.gz MHHWVFVFDNWXOU-QGZVFWFLSA-N 1 1 345.487 4.071 20 5 EIBDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000531910557 1031807288 /nfs/dbraw/zinc/80/72/88/1031807288.db2.gz MHHWVFVFDNWXOU-QGZVFWFLSA-N 1 1 345.487 4.071 20 5 EIBDMO Cc1cc(-c2noc([C@H]3CCC[N@H+]3C3CCCC3)n2)cc([N+](=O)[O-])c1 ZINC000453300696 1031818449 /nfs/dbraw/zinc/81/84/49/1031818449.db2.gz ZKYNYNUGXQJJQV-MRXNPFEDSA-N 1 1 342.399 4.033 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H]1CCc2cc(F)c(F)c(F)c21 ZINC000449590766 1031864263 /nfs/dbraw/zinc/86/42/63/1031864263.db2.gz VSTZLSAGMPECHA-AWEZNQCLSA-N 1 1 336.313 4.098 20 5 EIBDMO CCCCC[C@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000532013927 1031975429 /nfs/dbraw/zinc/97/54/29/1031975429.db2.gz INRPGBWBFXSJDH-INIZCTEOSA-N 1 1 334.416 4.006 20 5 EIBDMO CCCCC[C@@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000532013928 1031975864 /nfs/dbraw/zinc/97/58/64/1031975864.db2.gz INRPGBWBFXSJDH-MRXNPFEDSA-N 1 1 334.416 4.006 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](CC(=O)OC(C)(C)C)C1 ZINC000532127306 1032055226 /nfs/dbraw/zinc/05/52/26/1032055226.db2.gz RYFAFPJRDBJDHZ-HUUCEWRRSA-N 1 1 348.443 4.100 20 5 EIBDMO CC1(C)C[C@@H]([NH2+][C@@H]2COc3ccc(F)cc32)c2cc([N+](=O)[O-])ccc21 ZINC000433231541 1034078814 /nfs/dbraw/zinc/07/88/14/1034078814.db2.gz KKMGGEQTSAMAEA-IAGOWNOFSA-N 1 1 342.370 4.180 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]Cc2ncccc2F)s1 ZINC000126336371 1035490364 /nfs/dbraw/zinc/49/03/64/1035490364.db2.gz ZUODZFMVMMOPNG-UHFFFAOYSA-N 1 1 343.383 4.147 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccc(Cl)s1 ZINC000595007569 1035531671 /nfs/dbraw/zinc/53/16/71/1035531671.db2.gz MKTKIIMZRDPQFK-VIFPVBQESA-N 1 1 326.805 4.169 20 5 EIBDMO Cc1noc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)c1[N+](=O)[O-] ZINC000595414681 1035673145 /nfs/dbraw/zinc/67/31/45/1035673145.db2.gz JLUPHYFTOQOCHU-HNNXBMFYSA-N 1 1 335.791 4.176 20 5 EIBDMO CC(C)Oc1ccccc1[C@@H](C)[NH2+]Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595416531 1035674203 /nfs/dbraw/zinc/67/42/03/1035674203.db2.gz QRIOGHHKURUFMC-CYBMUJFWSA-N 1 1 332.375 4.372 20 5 EIBDMO Cc1noc(C[NH2+][C@H]2CC(C)(C)CCc3ccccc32)c1[N+](=O)[O-] ZINC000595471919 1035685144 /nfs/dbraw/zinc/68/51/44/1035685144.db2.gz GSYRJCBBGLLJFM-HNNXBMFYSA-N 1 1 329.400 4.085 20 5 EIBDMO Cc1noc(C[N@H+](C)[C@H]2CCCC[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000595548483 1035703256 /nfs/dbraw/zinc/70/32/56/1035703256.db2.gz SNUMZCUFWUORBN-HOTGVXAUSA-N 1 1 329.400 4.049 20 5 EIBDMO Cc1ncsc1C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491058189 1035799704 /nfs/dbraw/zinc/79/97/04/1035799704.db2.gz XHCPNJZJJWLBHB-SFHVURJKSA-N 1 1 339.420 4.239 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000596590292 1035907062 /nfs/dbraw/zinc/90/70/62/1035907062.db2.gz CMAVGXKFAOEDEJ-KBXCAEBGSA-N 1 1 325.412 4.442 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000596590292 1035907089 /nfs/dbraw/zinc/90/70/89/1035907089.db2.gz CMAVGXKFAOEDEJ-KBXCAEBGSA-N 1 1 325.412 4.442 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000485825238 1036304642 /nfs/dbraw/zinc/30/46/42/1036304642.db2.gz MQVTWIPAOYFNBE-GUXCAODWSA-N 1 1 340.423 4.426 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@@H](C)O[C@H](c2ccccc2)C1 ZINC000485825238 1036304662 /nfs/dbraw/zinc/30/46/62/1036304662.db2.gz MQVTWIPAOYFNBE-GUXCAODWSA-N 1 1 340.423 4.426 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@H](C)O[C@@H](c2ccccc2)C1 ZINC000485825241 1036305035 /nfs/dbraw/zinc/30/50/35/1036305035.db2.gz MQVTWIPAOYFNBE-TWOQFEAHSA-N 1 1 340.423 4.426 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@H](C)O[C@@H](c2ccccc2)C1 ZINC000485825241 1036305055 /nfs/dbraw/zinc/30/50/55/1036305055.db2.gz MQVTWIPAOYFNBE-TWOQFEAHSA-N 1 1 340.423 4.426 20 5 EIBDMO Cc1ccc([C@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)C2CC2)cc1 ZINC000602510647 1036486647 /nfs/dbraw/zinc/48/66/47/1036486647.db2.gz LILGZJJSMHUTRU-IBGZPJMESA-N 1 1 337.379 4.285 20 5 EIBDMO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1nc3cc([N+](=O)[O-])ccc3o1)CCC2 ZINC000602662431 1036559882 /nfs/dbraw/zinc/55/98/82/1036559882.db2.gz FNNLZIURUXNNSL-INIZCTEOSA-N 1 1 337.379 4.212 20 5 EIBDMO Cc1noc(C[NH2+][C@@H](c2ccc(F)cc2)C2CCCCC2)c1[N+](=O)[O-] ZINC000602966366 1036692731 /nfs/dbraw/zinc/69/27/31/1036692731.db2.gz BWKDQTCZVLBTGP-QGZVFWFLSA-N 1 1 347.390 4.442 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCC1(F)F ZINC000589520346 1036821048 /nfs/dbraw/zinc/82/10/48/1036821048.db2.gz ACYASIMANICELQ-GFCCVEGCSA-N 1 1 336.338 4.332 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2ccccc2)[C@@H](C)C2CC2)cc1[N+](=O)[O-] ZINC000061110628 1036844683 /nfs/dbraw/zinc/84/46/83/1036844683.db2.gz YIOYKVJOFMUMRW-HNNXBMFYSA-N 1 1 340.423 4.404 20 5 EIBDMO CC(C)CC[C@H]1CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000486779736 1036851577 /nfs/dbraw/zinc/85/15/77/1036851577.db2.gz NRMCFTWVRXIYDE-OAHLLOKOSA-N 1 1 344.415 4.045 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](c1ccccn1)C1CCC1 ZINC000599068006 1036868658 /nfs/dbraw/zinc/86/86/58/1036868658.db2.gz JPKYXUCWNSWFAR-DJJJIMSYSA-N 1 1 341.411 4.190 20 5 EIBDMO CC[N@@H+](Cc1cccc(Cl)c1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000061253808 1036969979 /nfs/dbraw/zinc/96/99/79/1036969979.db2.gz LQYPJVYYPVMBSD-UHFFFAOYSA-N 1 1 334.803 4.279 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](Cc1ccco1)C1CCCC1 ZINC000603855185 1037049013 /nfs/dbraw/zinc/04/90/13/1037049013.db2.gz DLHKKWGINPJOBB-UHFFFAOYSA-N 1 1 330.384 4.141 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](Cc1ccco1)C1CCCC1 ZINC000603855185 1037049022 /nfs/dbraw/zinc/04/90/22/1037049022.db2.gz DLHKKWGINPJOBB-UHFFFAOYSA-N 1 1 330.384 4.141 20 5 EIBDMO CCOc1ccc([C@@H]2CCC[N@@H+]2Cc2csc([N+](=O)[O-])c2)cc1 ZINC000603933529 1037094588 /nfs/dbraw/zinc/09/45/88/1037094588.db2.gz BIMBFAANXLPWAF-INIZCTEOSA-N 1 1 332.425 4.392 20 5 EIBDMO CCOc1ccc([C@@H]2CCC[N@H+]2Cc2csc([N+](=O)[O-])c2)cc1 ZINC000603933529 1037094607 /nfs/dbraw/zinc/09/46/07/1037094607.db2.gz BIMBFAANXLPWAF-INIZCTEOSA-N 1 1 332.425 4.392 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@@H](C)C2CC2)cc1 ZINC000057601234 1037135417 /nfs/dbraw/zinc/13/54/17/1037135417.db2.gz MEMPMRJQRVMIMP-HNNXBMFYSA-N 1 1 340.423 4.404 20 5 EIBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1 ZINC000604012540 1037146142 /nfs/dbraw/zinc/14/61/42/1037146142.db2.gz NXQIKXYRIDWOSK-LJQANCHMSA-N 1 1 344.386 4.340 20 5 EIBDMO C[C@H](c1ccc(F)cc1)[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000604012571 1037147045 /nfs/dbraw/zinc/14/70/45/1037147045.db2.gz RBGRFVRKKKYSPL-CQSZACIVSA-N 1 1 332.375 4.196 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@@H]2c2cccc(C)c2)cc1[N+](=O)[O-] ZINC000604013344 1037150993 /nfs/dbraw/zinc/15/09/93/1037150993.db2.gz BSENXXNXKMYHGK-QGZVFWFLSA-N 1 1 326.396 4.249 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@]1(c2ccc(Cl)cc2)C[C@H]1C ZINC000503403017 1037739537 /nfs/dbraw/zinc/73/95/37/1037739537.db2.gz CQTTXIPVPUMKNZ-XIKOKIGWSA-N 1 1 346.814 4.282 20 5 EIBDMO 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ITMKWAVWCNETCM-OAHLLOKOSA-N 1 1 332.444 4.109 20 5 EIBDMO CCC[C@@H]1[C@H](C)CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000464731290 1042136000 /nfs/dbraw/zinc/13/60/00/1042136000.db2.gz GXRHDSPFUVMPHE-CZUORRHYSA-N 1 1 344.415 4.045 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H](C)C[C@@H]1c1ccccc1F ZINC000464725057 1042140377 /nfs/dbraw/zinc/14/03/77/1042140377.db2.gz LNVLPKBCIQYGEP-FZKQIMNGSA-N 1 1 344.386 4.326 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](C)C[C@@H]1c1ccccc1F ZINC000464725057 1042140381 /nfs/dbraw/zinc/14/03/81/1042140381.db2.gz LNVLPKBCIQYGEP-FZKQIMNGSA-N 1 1 344.386 4.326 20 5 EIBDMO CCC[C@]1(C)CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000464841019 1042191589 /nfs/dbraw/zinc/19/15/89/1042191589.db2.gz VYOWIJYCRVPFQE-GOSISDBHSA-N 1 1 344.415 4.047 20 5 EIBDMO C[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccco2)C1 ZINC000464850630 1042197493 /nfs/dbraw/zinc/19/74/93/1042197493.db2.gz IMVDIPQBGWXDER-RHSMWYFYSA-N 1 1 330.384 4.040 20 5 EIBDMO COc1cccc(C2([NH2+]Cc3cc(Cl)ccc3[N+](=O)[O-])CC2)c1 ZINC000271749576 1042297202 /nfs/dbraw/zinc/29/72/02/1042297202.db2.gz YDOFOVIABCRCJG-UHFFFAOYSA-N 1 1 332.787 4.036 20 5 EIBDMO CCC(CC)n1ccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)n1 ZINC000271756216 1042313098 /nfs/dbraw/zinc/31/30/98/1042313098.db2.gz DQFVUWXQUDVZEE-AWEZNQCLSA-N 1 1 330.432 4.312 20 5 EIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](C(C)(C)C)C1 ZINC000542320320 1042386966 /nfs/dbraw/zinc/38/69/66/1042386966.db2.gz GBCBAMHJYRXUEL-TZMCWYRMSA-N 1 1 344.415 4.074 20 5 EIBDMO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000271821884 1042411504 /nfs/dbraw/zinc/41/15/04/1042411504.db2.gz SHPWHZJOTXZWNG-QWHCGFSZSA-N 1 1 330.432 4.267 20 5 EIBDMO CCC[N@@H+](C)Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000506442614 1042424949 /nfs/dbraw/zinc/42/49/49/1042424949.db2.gz HCUUMIWNVGBLQO-UHFFFAOYSA-N 1 1 344.411 4.024 20 5 EIBDMO 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ZINC000518838620 1042717737 /nfs/dbraw/zinc/71/77/37/1042717737.db2.gz XFMXODPEAMNMRZ-UHFFFAOYSA-N 1 1 332.444 4.109 20 5 EIBDMO CCS[C@@H]1CC[C@@H]([N@H+](C)Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493136844 1042828105 /nfs/dbraw/zinc/82/81/05/1042828105.db2.gz ZYMLCOXQPBWZCP-VXGBXAGGSA-N 1 1 328.865 4.354 20 5 EIBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493136844 1042828106 /nfs/dbraw/zinc/82/81/06/1042828106.db2.gz ZYMLCOXQPBWZCP-VXGBXAGGSA-N 1 1 328.865 4.354 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccc(O)c2)CC2CC2)cc1Cl ZINC000761505037 1042873998 /nfs/dbraw/zinc/87/39/98/1042873998.db2.gz CXGPTWKFBPTERY-UHFFFAOYSA-N 1 1 346.814 4.366 20 5 EIBDMO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000611554144 1043047497 /nfs/dbraw/zinc/04/74/97/1043047497.db2.gz GDKVGHJYGUSMTG-OLZOCXBDSA-N 1 1 346.349 4.027 20 5 EIBDMO C[C@@H](C1CC1)[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CC1 ZINC000507995644 1043230035 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346.402 4.196 20 5 EIBDMO C[C@H]([NH2+]Cc1cccnc1OC1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000173318356 1043890756 /nfs/dbraw/zinc/89/07/56/1043890756.db2.gz NUWOMMNIJYWZSD-AWEZNQCLSA-N 1 1 341.411 4.162 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1cnc(C(C)C)nc1 ZINC000443063998 1043984218 /nfs/dbraw/zinc/98/42/18/1043984218.db2.gz OEECRIZTKOKICL-NVNXTCNLSA-N 1 1 340.427 4.044 20 5 EIBDMO CC(C)C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)CC(C)(C)C ZINC000474220390 1044803602 /nfs/dbraw/zinc/80/36/02/1044803602.db2.gz VAKCEYREJZMTHV-UHFFFAOYSA-N 1 1 346.431 4.149 20 5 EIBDMO Cc1nc(C)c([C@H](C)[N@@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])s1 ZINC000093274877 1044827884 /nfs/dbraw/zinc/82/78/84/1044827884.db2.gz LGNGVWOBHYHUGD-XOVSCCBYSA-N 1 1 331.441 4.374 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@@H](c3ccccn3)C3CC3)o2)c1 ZINC000922586991 1044832357 /nfs/dbraw/zinc/83/23/57/1044832357.db2.gz UZSRGSDJZZNSJL-HXUWFJFHSA-N 1 1 349.390 4.491 20 5 EIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCS[C@H](c2ccccc2)C1 ZINC000735495500 1044832545 /nfs/dbraw/zinc/83/25/45/1044832545.db2.gz XWOIHWYZOQQEED-KRWDZBQOSA-N 1 1 332.400 4.024 20 5 EIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCS[C@H](c2ccccc2)C1 ZINC000735495500 1044832549 /nfs/dbraw/zinc/83/25/49/1044832549.db2.gz XWOIHWYZOQQEED-KRWDZBQOSA-N 1 1 332.400 4.024 20 5 EIBDMO Cc1cc([C@H](C)[NH2+]Cc2c(F)cc([N+](=O)[O-])cc2F)c(C)s1 ZINC000508966062 1044846062 /nfs/dbraw/zinc/84/60/62/1044846062.db2.gz VEJCSCWCZZINPX-VIFPVBQESA-N 1 1 326.368 4.402 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CCCc3cccnc32)o1 ZINC000922880707 1045019653 /nfs/dbraw/zinc/01/96/53/1045019653.db2.gz JEVBXDCXLHFHGE-KRWDZBQOSA-N 1 1 349.390 4.417 20 5 EIBDMO COCC[C@H]1CCCC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000470208341 1045063052 /nfs/dbraw/zinc/06/30/52/1045063052.db2.gz RLOCHBVYXWLCMQ-NWNNTGRJSA-N 1 1 332.444 4.137 20 5 EIBDMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](CCCc1cccc3ccccc31)CC2 ZINC000495465411 1045143905 /nfs/dbraw/zinc/14/39/05/1045143905.db2.gz NPXPZFYNBPWGGF-UHFFFAOYSA-N 1 1 347.418 4.134 20 5 EIBDMO Cc1ccc(CNc2ccc(Cl)cc2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000302062236 1045159422 /nfs/dbraw/zinc/15/94/22/1045159422.db2.gz UFBUGHPRINNPNY-UHFFFAOYSA-N 1 1 346.818 4.164 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]Cc1ccc2ccccc2n1 ZINC000740004775 1045174330 /nfs/dbraw/zinc/17/43/30/1045174330.db2.gz VVUCEDVSNLURPU-UHFFFAOYSA-N 1 1 327.771 4.086 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(Br)cc2[N+](=O)[O-])o1 ZINC000162140117 1045219476 /nfs/dbraw/zinc/21/94/76/1045219476.db2.gz MPXXWZISKJOFAF-SNVBAGLBSA-N 1 1 339.189 4.110 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2nccc3ccccc32)C2CC2)cc1 ZINC000611254754 1045267375 /nfs/dbraw/zinc/26/73/75/1045267375.db2.gz IMTYDBNDTUVHBQ-UHFFFAOYSA-N 1 1 333.391 4.308 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@@H]3C3CC3)cs2)c1 ZINC000611268571 1045271809 /nfs/dbraw/zinc/27/18/09/1045271809.db2.gz USGAKPSLNNURTB-MRXNPFEDSA-N 1 1 329.425 4.093 20 5 EIBDMO C[NH+](C)[C@H](CNc1sccc1[N+](=O)[O-])c1ccccc1Cl ZINC000611411018 1045303639 /nfs/dbraw/zinc/30/36/39/1045303639.db2.gz KJWHNUQFXWLRAW-CYBMUJFWSA-N 1 1 325.821 4.025 20 5 EIBDMO C[C@@H](C1CC1)[N@@H+](Cc1c(Br)cccc1[N+](=O)[O-])C1CC1 ZINC000768533500 1045816919 /nfs/dbraw/zinc/81/69/19/1045816919.db2.gz YYRQXQQDFUQJBG-JTQLQIEISA-N 1 1 339.233 4.120 20 5 EIBDMO C[C@@H](C1CC1)[N@H+](Cc1c(Br)cccc1[N+](=O)[O-])C1CC1 ZINC000768533500 1045816914 /nfs/dbraw/zinc/81/69/14/1045816914.db2.gz YYRQXQQDFUQJBG-JTQLQIEISA-N 1 1 339.233 4.120 20 5 EIBDMO COc1ccc(C[C@@H](C)[N@@H+](C)[C@@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC001170355582 1046010754 /nfs/dbraw/zinc/01/07/54/1046010754.db2.gz KVTFLXKAVYOARK-AUUYWEPGSA-N 1 1 340.423 4.154 20 5 EIBDMO C[C@H]1C[N@@H+](Cc2c3ccccc3cc3ccccc32)C[C@]2(CCOC2)O1 ZINC000793362878 1046215971 /nfs/dbraw/zinc/21/59/71/1046215971.db2.gz OYVDDAGPTQSERQ-SBUREZEXSA-N 1 1 347.458 4.373 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@H]1CCCc2c(O)cccc21 ZINC000192356637 1046232527 /nfs/dbraw/zinc/23/25/27/1046232527.db2.gz LNMPMSXSZMPCKR-HNNXBMFYSA-N 1 1 332.787 4.121 20 5 EIBDMO Cc1ccc(C2=CC[N@@H+](CCOc3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000916995595 1046545028 /nfs/dbraw/zinc/54/50/28/1046545028.db2.gz OCLCTKJFOFCTSX-UHFFFAOYSA-N 1 1 338.407 4.071 20 5 EIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC=C(c2ccc(F)cc2)CC1 ZINC000916997017 1046548599 /nfs/dbraw/zinc/54/85/99/1046548599.db2.gz QQLUKDFNCJCKJU-UHFFFAOYSA-N 1 1 330.334 4.162 20 5 EIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CC=C(c2ccc(F)cc2)CC1 ZINC000916997017 1046548613 /nfs/dbraw/zinc/54/86/13/1046548613.db2.gz QQLUKDFNCJCKJU-UHFFFAOYSA-N 1 1 330.334 4.162 20 5 EIBDMO CO[C@H](C)C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C(C)C ZINC000536659827 1046626884 /nfs/dbraw/zinc/62/68/84/1046626884.db2.gz IIOUWUGZTITKPO-CQSZACIVSA-N 1 1 332.400 4.100 20 5 EIBDMO C[C@@H](CCO)[N@@H+](Cc1ccccc1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000772387377 1046630552 /nfs/dbraw/zinc/63/05/52/1046630552.db2.gz HRYQWKCSNPFPJW-AWEZNQCLSA-N 1 1 348.830 4.021 20 5 EIBDMO CC[C@@H](c1ccccc1OC)[N@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000805834877 1047026574 /nfs/dbraw/zinc/02/65/74/1047026574.db2.gz JFKBIQLVEJGKAK-INIZCTEOSA-N 1 1 332.375 4.326 20 5 EIBDMO CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000805834877 1047026590 /nfs/dbraw/zinc/02/65/90/1047026590.db2.gz JFKBIQLVEJGKAK-INIZCTEOSA-N 1 1 332.375 4.326 20 5 EIBDMO C[C@H]1C[C@@H](c2ccccc2)[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC001170084550 1047184486 /nfs/dbraw/zinc/18/44/86/1047184486.db2.gz BWZIUQKAQXUIBP-KXBFYZLASA-N 1 1 326.396 4.057 20 5 EIBDMO C[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)Cc1ccccc1C(F)(F)F ZINC000788468906 1047195730 /nfs/dbraw/zinc/19/57/30/1047195730.db2.gz ICMHGOQNIHOYMI-UHFFFAOYSA-N 1 1 342.292 4.385 20 5 EIBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)Cc1ccccc1C(F)(F)F ZINC000788468906 1047195737 /nfs/dbraw/zinc/19/57/37/1047195737.db2.gz ICMHGOQNIHOYMI-UHFFFAOYSA-N 1 1 342.292 4.385 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@H](C)c1cccc(OC)c1 ZINC000788478403 1047197911 /nfs/dbraw/zinc/19/79/11/1047197911.db2.gz JSAWKQRFNISUQJ-CYBMUJFWSA-N 1 1 332.375 4.326 20 5 EIBDMO C[NH+](C)[C@@H](CNc1cccc(F)c1[N+](=O)[O-])c1ccccc1Cl ZINC000918755628 1047645343 /nfs/dbraw/zinc/64/53/43/1047645343.db2.gz YNMDFMYEAFSKCY-HNNXBMFYSA-N 1 1 337.782 4.102 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3ccnc(Cl)c3F)C2)cc1 ZINC000824820783 1047956454 /nfs/dbraw/zinc/95/64/54/1047956454.db2.gz MTAPORNWNDPFQD-ZDUSSCGKSA-N 1 1 349.793 4.162 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3ccnc(Cl)c3F)C2)cc1 ZINC000824820783 1047956460 /nfs/dbraw/zinc/95/64/60/1047956460.db2.gz MTAPORNWNDPFQD-ZDUSSCGKSA-N 1 1 349.793 4.162 20 5 EIBDMO CSCC[C@H](C)[N@@H+](C)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809962455 1048571949 /nfs/dbraw/zinc/57/19/49/1048571949.db2.gz OIGQQJGVDPULJG-VIFPVBQESA-N 1 1 337.272 4.475 20 5 EIBDMO Cc1csc([C@@H]2CCC[N@@H+](Cc3cccc([N+](=O)[O-])c3C)C2)n1 ZINC000195322576 1048658006 /nfs/dbraw/zinc/65/80/06/1048658006.db2.gz NRWMSXSGFHQYJT-OAHLLOKOSA-N 1 1 331.441 4.048 20 5 EIBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)c1cc[nH]c1 ZINC001146889184 1049067005 /nfs/dbraw/zinc/06/70/05/1049067005.db2.gz UTUWGSSECONXQX-UHFFFAOYSA-N 1 1 344.418 4.343 20 5 EIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000609541331 1049142773 /nfs/dbraw/zinc/14/27/73/1049142773.db2.gz IMTMFTVSEQEBNS-HNNXBMFYSA-N 1 1 346.814 4.117 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000609541479 1049144801 /nfs/dbraw/zinc/14/48/01/1049144801.db2.gz ROZAYOZJKCKYCO-AWEZNQCLSA-N 1 1 346.814 4.246 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)ccc1Cl ZINC001171319079 1049255116 /nfs/dbraw/zinc/25/51/16/1049255116.db2.gz GPAGXPLESKZQPT-NSHDSACASA-N 1 1 336.741 4.413 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)ccc1Cl ZINC001171319079 1049255137 /nfs/dbraw/zinc/25/51/37/1049255137.db2.gz GPAGXPLESKZQPT-NSHDSACASA-N 1 1 336.741 4.413 20 5 EIBDMO CN(C)c1cccc([C@@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000609846421 1049355001 /nfs/dbraw/zinc/35/50/01/1049355001.db2.gz BYCPZTAHEAYHHP-FQEVSTJZSA-N 1 1 339.439 4.040 20 5 EIBDMO CC[C@H](C)[C@H]1CCCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000610091401 1049533860 /nfs/dbraw/zinc/53/38/60/1049533860.db2.gz QJKSUWDVIURUTR-XJKSGUPXSA-N 1 1 344.415 4.045 20 5 EIBDMO COc1cccc2cc(C[NH2+]C(C)(C)c3ccccc3[N+](=O)[O-])oc21 ZINC000813792412 1049817675 /nfs/dbraw/zinc/81/76/75/1049817675.db2.gz YKFRIUPPNLXKGE-UHFFFAOYSA-N 1 1 340.379 4.375 20 5 EIBDMO CCOc1cc(C[N@@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)ccc1[N+](=O)[O-] ZINC000617219573 1049970057 /nfs/dbraw/zinc/97/00/57/1049970057.db2.gz ZQRUYXONQXJGDF-YPMHNXCESA-N 1 1 346.349 4.156 20 5 EIBDMO CCOc1cc(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)ccc1[N+](=O)[O-] ZINC000617219573 1049970060 /nfs/dbraw/zinc/97/00/60/1049970060.db2.gz ZQRUYXONQXJGDF-YPMHNXCESA-N 1 1 346.349 4.156 20 5 EIBDMO C[C@H]1CCC[C@@H]([N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000170909078 1050105801 /nfs/dbraw/zinc/10/58/01/1050105801.db2.gz XVUNWWJJTOHDPM-GOEBONIOSA-N 1 1 343.427 4.303 20 5 EIBDMO C[N@@H+](Cc1ccc(Cl)nc1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172922640 1050236636 /nfs/dbraw/zinc/23/66/36/1050236636.db2.gz ZUCYICHDLMFGGO-INIZCTEOSA-N 1 1 345.830 4.023 20 5 EIBDMO C[C@@H]1CC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCC1(F)F ZINC001172909693 1050245488 /nfs/dbraw/zinc/24/54/88/1050245488.db2.gz UXVIGGXOISIIPS-CZUORRHYSA-N 1 1 338.398 4.209 20 5 EIBDMO CC[N@@H+]([C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-])C1CCCCC1 ZINC001173184857 1050338542 /nfs/dbraw/zinc/33/85/42/1050338542.db2.gz PDNZPQVADIISGR-CYBMUJFWSA-N 1 1 338.423 4.328 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC001173227219 1050356805 /nfs/dbraw/zinc/35/68/05/1050356805.db2.gz ONRWLOUFZFGPOI-GDBMZVCRSA-N 1 1 328.387 4.154 20 5 EIBDMO COc1ccccc1[C@H]1CC[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173228976 1050357037 /nfs/dbraw/zinc/35/70/37/1050357037.db2.gz OWXKJYJRCFVPIA-WBVHZDCISA-N 1 1 340.423 4.024 20 5 EIBDMO COc1ccc([C@@H](C)[N@@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173234509 1050362333 /nfs/dbraw/zinc/36/23/33/1050362333.db2.gz RSPFFCBLXVFUCD-LSDHHAIUSA-N 1 1 328.412 4.227 20 5 EIBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](C3CCCCC3)C2)c(C(F)F)c1 ZINC001187080850 1050478125 /nfs/dbraw/zinc/47/81/25/1050478125.db2.gz FJUCIBBXVVTVCY-GFCCVEGCSA-N 1 1 339.386 4.351 20 5 EIBDMO CS[C@H]1CC[C@@H]([N@@H+](C)Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001180071808 1050872687 /nfs/dbraw/zinc/87/26/87/1050872687.db2.gz IBFDUNNFCUQSNL-OLZOCXBDSA-N 1 1 348.390 4.330 20 5 EIBDMO CC(C)C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC001190615389 1051221571 /nfs/dbraw/zinc/22/15/71/1051221571.db2.gz AKLAAKATWHKVFR-UHFFFAOYSA-N 1 1 328.412 4.132 20 5 EIBDMO CCCOc1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c(C)c1 ZINC001181697587 1051290252 /nfs/dbraw/zinc/29/02/52/1051290252.db2.gz LJACOUONHQAMRM-UHFFFAOYSA-N 1 1 342.439 4.367 20 5 EIBDMO C[C@@H](c1cccnc1)[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000183724876 1051328965 /nfs/dbraw/zinc/32/89/65/1051328965.db2.gz HSYKIVKDHMKKCP-AWEZNQCLSA-N 1 1 337.379 4.443 20 5 EIBDMO CC(C)=CCC[C@H](C)CC[NH+]1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC001182226352 1051437155 /nfs/dbraw/zinc/43/71/55/1051437155.db2.gz IZLCPTHZITXUBV-INIZCTEOSA-N 1 1 332.444 4.430 20 5 EIBDMO CC[C@@H](Cc1ccccc1)[N@@H+](CC)CCOc1cccc([N+](=O)[O-])c1 ZINC001192107416 1051633242 /nfs/dbraw/zinc/63/32/42/1051633242.db2.gz HOSLLNKQNPMITD-SFHVURJKSA-N 1 1 342.439 4.317 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](OC2CCC2)C1 ZINC001182633985 1051654189 /nfs/dbraw/zinc/65/41/89/1051654189.db2.gz HGBBIQFLFMVFJR-FERCGXDMSA-N 1 1 330.428 4.032 20 5 EIBDMO C[C@H]([NH2+]Cc1c(Br)cccc1[N+](=O)[O-])c1ccccc1 ZINC001192546819 1051755173 /nfs/dbraw/zinc/75/51/73/1051755173.db2.gz OPJMVORNUAFTDW-NSHDSACASA-N 1 1 335.201 4.208 20 5 EIBDMO CC(C)[C@@H]1CCCCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC001192653106 1051780779 /nfs/dbraw/zinc/78/07/79/1051780779.db2.gz LNNWVEHKLNKCRH-INIZCTEOSA-N 1 1 344.415 4.045 20 5 EIBDMO Cc1[nH+]ccn1Cc1ccc(Nc2ccc(/C=C/[N+](=O)[O-])cc2)cc1 ZINC001175902974 1051837650 /nfs/dbraw/zinc/83/76/50/1051837650.db2.gz ZEDQILYICFNDTR-ZRDIBKRKSA-N 1 1 334.379 4.231 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](CC[C@H]2CC2(Cl)Cl)C2CC2)cc1 ZINC001192928168 1051838319 /nfs/dbraw/zinc/83/83/19/1051838319.db2.gz GRWGRVQZHKOGEL-LBPRGKRZSA-N 1 1 329.227 4.143 20 5 EIBDMO C[C@@H]([NH2+]Cc1csc(-c2ccoc2)n1)c1ccc([N+](=O)[O-])cc1 ZINC001176028244 1051879727 /nfs/dbraw/zinc/87/97/27/1051879727.db2.gz LDVWVAKUFOKVEV-LLVKDONJSA-N 1 1 329.381 4.162 20 5 EIBDMO CCOc1cc(C[N@@H+](CCc2ccccc2)C2CC2)ccc1[N+](=O)[O-] ZINC001176414698 1052067237 /nfs/dbraw/zinc/06/72/37/1052067237.db2.gz ZJSSAMLXAPMMLS-UHFFFAOYSA-N 1 1 340.423 4.201 20 5 EIBDMO CCC(=O)c1ccc(NCCC[N@@H+](C)C2CCCCC2)c([N+](=O)[O-])c1 ZINC001184644471 1052067980 /nfs/dbraw/zinc/06/79/80/1052067980.db2.gz PKRYZUJEAIYKPE-UHFFFAOYSA-N 1 1 347.459 4.254 20 5 EIBDMO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC001194106805 1052073132 /nfs/dbraw/zinc/07/31/32/1052073132.db2.gz BPJITKVDMUHTOU-SFHVURJKSA-N 1 1 328.412 4.495 20 5 EIBDMO C[N@H+](C/C=C\c1ccc(Cl)cc1)CCc1ccccc1[N+](=O)[O-] ZINC001194263279 1052120508 /nfs/dbraw/zinc/12/05/08/1052120508.db2.gz WOCCTZUZSOGYKB-PLNGDYQASA-N 1 1 330.815 4.436 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CCCc3ccsc3)C2)cc1 ZINC001194478747 1052158743 /nfs/dbraw/zinc/15/87/43/1052158743.db2.gz XZWCTGVDKUKEKW-KRWDZBQOSA-N 1 1 330.453 4.469 20 5 EIBDMO C[C@H](c1ccccc1)[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C1CC1 ZINC000774836249 1052182627 /nfs/dbraw/zinc/18/26/27/1052182627.db2.gz QXWRSWUUIMLZNC-CYBMUJFWSA-N 1 1 341.367 4.229 20 5 EIBDMO C[C@H](c1ccccc1)[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C1CC1 ZINC000774836249 1052182635 /nfs/dbraw/zinc/18/26/35/1052182635.db2.gz QXWRSWUUIMLZNC-CYBMUJFWSA-N 1 1 341.367 4.229 20 5 EIBDMO C[C@H](Nc1cc[nH+]c2ccc(Cl)cc12)c1ccc([N+](=O)[O-])cc1 ZINC000864018998 1053150592 /nfs/dbraw/zinc/15/05/92/1053150592.db2.gz IUSXMSAFHBUUGJ-NSHDSACASA-N 1 1 327.771 4.391 20 5 EIBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccc(C(F)F)nc1 ZINC000850445203 1053218715 /nfs/dbraw/zinc/21/87/15/1053218715.db2.gz PZYOODUXCRLIFM-SECBINFHSA-N 1 1 341.745 4.432 20 5 EIBDMO C[C@H]1CCCCC[N@@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159430909 1053342568 /nfs/dbraw/zinc/34/25/68/1053342568.db2.gz OVIBFLMPPNCSLS-NSHDSACASA-N 1 1 327.222 4.122 20 5 EIBDMO C[C@H]1CCCCC[N@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159430909 1053342584 /nfs/dbraw/zinc/34/25/84/1053342584.db2.gz OVIBFLMPPNCSLS-NSHDSACASA-N 1 1 327.222 4.122 20 5 EIBDMO CC(C)CC(C)(C)C[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000552062205 1053365806 /nfs/dbraw/zinc/36/58/06/1053365806.db2.gz PKIDUZRQSLQBBS-KRWDZBQOSA-N 1 1 344.459 4.080 20 5 EIBDMO CC(C)n1cc2c(n1)[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)CCC2 ZINC000764937639 1053388005 /nfs/dbraw/zinc/38/80/05/1053388005.db2.gz DNPJQBCNCOLZQR-SUMWQHHRSA-N 1 1 328.416 4.100 20 5 EIBDMO C[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)CCc2ccc(F)cc21 ZINC001195704662 1053463853 /nfs/dbraw/zinc/46/38/53/1053463853.db2.gz OWKSNHUGSHOAEF-LBPRGKRZSA-N 1 1 332.350 4.035 20 5 EIBDMO Cc1ccc([C@H]2CCCCC[N@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000776584728 1053560688 /nfs/dbraw/zinc/56/06/88/1053560688.db2.gz PKNBHDZLXTVBIS-MSOLQXFVSA-N 1 1 344.411 4.147 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH+]2CCC([C@@H]3CCCCO3)CC2)ccc1Cl ZINC000852595755 1053593539 /nfs/dbraw/zinc/59/35/39/1053593539.db2.gz VILVKLOYOVRVNB-KRWDZBQOSA-N 1 1 338.835 4.029 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@H]([C@H]3CCCCO3)C2)c1 ZINC000852596382 1053593945 /nfs/dbraw/zinc/59/39/45/1053593945.db2.gz LHLYVIYHZCBXEM-SUMWQHHRSA-N 1 1 338.835 4.029 20 5 EIBDMO Cc1cncc([C@H]2CCCN2c2cc[nH+]c3ccc([N+](=O)[O-])cc32)c1 ZINC000866275376 1053673562 /nfs/dbraw/zinc/67/35/62/1053673562.db2.gz AHUVKOXDSBURKI-GOSISDBHSA-N 1 1 334.379 4.188 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](N(C)c2ccccc2)C1 ZINC001196505720 1053686510 /nfs/dbraw/zinc/68/65/10/1053686510.db2.gz FRAZSLIGWCYGGP-VQIMIIECSA-N 1 1 339.439 4.175 20 5 EIBDMO C[N@H+]1CCC[C@@H](CNc2ccccc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000301409066 1053870542 /nfs/dbraw/zinc/87/05/42/1053870542.db2.gz IYWFWXVVBBBEIJ-SUMWQHHRSA-N 1 1 331.441 4.151 20 5 EIBDMO C[C@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H]1c1ccccc1 ZINC001197661421 1053961316 /nfs/dbraw/zinc/96/13/16/1053961316.db2.gz VOCSBYATLUUCDZ-DJJJIMSYSA-N 1 1 336.395 4.054 20 5 EIBDMO C[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H]1c1ccccc1 ZINC001197661421 1053961332 /nfs/dbraw/zinc/96/13/32/1053961332.db2.gz VOCSBYATLUUCDZ-DJJJIMSYSA-N 1 1 336.395 4.054 20 5 EIBDMO CC(C)[N@H+](C)Cc1ccccc1CN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000173320192 1054020940 /nfs/dbraw/zinc/02/09/40/1054020940.db2.gz MVMKMZBKSAXUNB-MRXNPFEDSA-N 1 1 341.455 4.286 20 5 EIBDMO CC(C)[N@@H+](C)Cc1ccccc1CN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000173320192 1054020952 /nfs/dbraw/zinc/02/09/52/1054020952.db2.gz MVMKMZBKSAXUNB-MRXNPFEDSA-N 1 1 341.455 4.286 20 5 EIBDMO CCCc1nc(C)c(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2SC)o1 ZINC000872072763 1054378885 /nfs/dbraw/zinc/37/88/85/1054378885.db2.gz JRJQIQFZLLERQW-NSHDSACASA-N 1 1 349.456 4.416 20 5 EIBDMO Cc1csc([C@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)n1 ZINC000877814254 1055128349 /nfs/dbraw/zinc/12/83/49/1055128349.db2.gz WPWFOJWKEPNUPR-NSHDSACASA-N 1 1 337.832 4.003 20 5 EIBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273252905 1055569527 /nfs/dbraw/zinc/56/95/27/1055569527.db2.gz AJALDVBIYHJLNO-OALUTQOASA-N 1 1 344.386 4.086 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1NC[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000301484951 1055639780 /nfs/dbraw/zinc/63/97/80/1055639780.db2.gz WCARNSIOQNZZFF-KSSFIOAISA-N 1 1 345.468 4.460 20 5 EIBDMO C[C@H]1C[C@@H](Nc2cccc(F)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000301508516 1055648399 /nfs/dbraw/zinc/64/83/99/1055648399.db2.gz AQBPSVXDGNISDJ-HOCLYGCPSA-N 1 1 343.402 4.199 20 5 EIBDMO Cc1[nH+]ccn1-c1ccc(CNc2cc(C)ccc2[N+](=O)[O-])cc1F ZINC000301588669 1055742228 /nfs/dbraw/zinc/74/22/28/1055742228.db2.gz XTLKVPFLTAKYCV-UHFFFAOYSA-N 1 1 340.358 4.149 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+][C@H]2CCCc3cn(C(C)C)nc32)cc1[N+](=O)[O-] ZINC000765825835 1055805507 /nfs/dbraw/zinc/80/55/07/1055805507.db2.gz WKRFTZYDOKVGQW-YOEHRIQHSA-N 1 1 342.443 4.409 20 5 EIBDMO C[C@@H](NC[C@H](c1ccccc1)[NH+]1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000327258674 1056389580 /nfs/dbraw/zinc/38/95/80/1056389580.db2.gz CSUONEMHLXJKOR-OXQOHEQNSA-N 1 1 339.439 4.083 20 5 EIBDMO CC[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@H](O)c1ccc(C)cc1 ZINC000743865203 1059182702 /nfs/dbraw/zinc/18/27/02/1059182702.db2.gz YOXBBDQOXMDRHV-SFHVURJKSA-N 1 1 348.830 4.112 20 5 EIBDMO C[C@]1(Cc2ccccc2)CCC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC001168967844 1060562539 /nfs/dbraw/zinc/56/25/39/1060562539.db2.gz BQTXZRTVLUWKRB-LJQANCHMSA-N 1 1 328.387 4.331 20 5 EIBDMO C[N@@H+](Cc1ccccc1Oc1ccccc1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169035195 1060590189 /nfs/dbraw/zinc/59/01/89/1060590189.db2.gz BJRPIAYNGIEQEL-SJLPKXTDSA-N 1 1 340.423 4.356 20 5 EIBDMO CCC1(CC)C[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CCS1 ZINC001169023569 1060603276 /nfs/dbraw/zinc/60/32/76/1060603276.db2.gz GKZICOVKHOJLAQ-UHFFFAOYSA-N 1 1 328.865 4.356 20 5 EIBDMO CCC1(CC)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CCS1 ZINC001169023569 1060603284 /nfs/dbraw/zinc/60/32/84/1060603284.db2.gz GKZICOVKHOJLAQ-UHFFFAOYSA-N 1 1 328.865 4.356 20 5 EIBDMO CC(=O)N1CC[C@H]([N@@H+](C)Cc2c3ccccc3cc3ccccc32)C1 ZINC001169556580 1060855906 /nfs/dbraw/zinc/85/59/06/1060855906.db2.gz RQLBFRZWAGBNGK-IBGZPJMESA-N 1 1 332.447 4.046 20 5 EIBDMO O=[N+]([O-])c1ncccc1C[N@H+](Cc1ccccc1F)C1CCCCC1 ZINC001168265531 1032165529 /nfs/dbraw/zinc/16/55/29/1032165529.db2.gz RMWHNBPGHDQUGF-UHFFFAOYSA-N 1 1 343.402 4.464 20 5 EIBDMO O=[N+]([O-])c1ncccc1C[N@@H+](Cc1ccccc1F)C1CCCCC1 ZINC001168265531 1032165535 /nfs/dbraw/zinc/16/55/35/1032165535.db2.gz RMWHNBPGHDQUGF-UHFFFAOYSA-N 1 1 343.402 4.464 20 5 EIBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC001307494062 1032223847 /nfs/dbraw/zinc/22/38/47/1032223847.db2.gz CUGFEVHLMVLCHA-OCCSQVGLSA-N 1 1 328.865 4.354 20 5 EIBDMO CC(=O)c1cccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000450282132 1032399050 /nfs/dbraw/zinc/39/90/50/1032399050.db2.gz GHRNVBSQUIEMBW-UHFFFAOYSA-N 1 1 326.396 4.208 20 5 EIBDMO CC[C@H](C)[C@H](C)[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CC1 ZINC000532963257 1032415240 /nfs/dbraw/zinc/41/52/40/1032415240.db2.gz BKXFERBNNMMWJQ-STQMWFEESA-N 1 1 344.415 4.044 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H](C)c1cccc(O)c1 ZINC000533377770 1032698761 /nfs/dbraw/zinc/69/87/61/1032698761.db2.gz NKCFESTVAUENIS-CQSZACIVSA-N 1 1 344.411 4.281 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H](C)c1cccc(O)c1 ZINC000533377770 1032698764 /nfs/dbraw/zinc/69/87/64/1032698764.db2.gz NKCFESTVAUENIS-CQSZACIVSA-N 1 1 344.411 4.281 20 5 EIBDMO CC[C@H]1CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000533435601 1032762434 /nfs/dbraw/zinc/76/24/34/1032762434.db2.gz NGFTZAZYJQYHSH-HNNXBMFYSA-N 1 1 343.427 4.304 20 5 EIBDMO COCC(C)(C)[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000430152050 1018880128 /nfs/dbraw/zinc/88/01/28/1018880128.db2.gz SLHIBTHADJXUCE-UHFFFAOYSA-N 1 1 334.441 4.180 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000430196177 1019184119 /nfs/dbraw/zinc/18/41/19/1019184119.db2.gz QHVRGDQXVVAHLE-KRWDZBQOSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000430196177 1019184127 /nfs/dbraw/zinc/18/41/27/1019184127.db2.gz QHVRGDQXVVAHLE-KRWDZBQOSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1ccco1)C1CCCC1 ZINC000430214180 1019395477 /nfs/dbraw/zinc/39/54/77/1019395477.db2.gz XLCJVRKOXCSGFI-UHFFFAOYSA-N 1 1 330.384 4.141 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](Cc1ccco1)C1CCCC1 ZINC000430214180 1019395493 /nfs/dbraw/zinc/39/54/93/1019395493.db2.gz XLCJVRKOXCSGFI-UHFFFAOYSA-N 1 1 330.384 4.141 20 5 EIBDMO CC[C@H]1CCC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000246994335 1020321706 /nfs/dbraw/zinc/32/17/06/1020321706.db2.gz GIUUGRTTXMDZKM-KGLIPLIRSA-N 1 1 344.415 4.218 20 5 EIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@@H]2C2CCC2)c1 ZINC001167307637 1021003533 /nfs/dbraw/zinc/00/35/33/1021003533.db2.gz ZMQLTUQBAGJISB-OAHLLOKOSA-N 1 1 328.334 4.378 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000610368735 1021541672 /nfs/dbraw/zinc/54/16/72/1021541672.db2.gz HTFCLJOEZCKRAB-HNAYVOBHSA-N 1 1 326.396 4.119 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000610368736 1021542701 /nfs/dbraw/zinc/54/27/01/1021542701.db2.gz HTFCLJOEZCKRAB-KXBFYZLASA-N 1 1 326.396 4.119 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000610368733 1021543370 /nfs/dbraw/zinc/54/33/70/1021543370.db2.gz HTFCLJOEZCKRAB-BEFAXECRSA-N 1 1 326.396 4.119 20 5 EIBDMO CC(C)[C@@H]1CCCC[N@H+]1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC001167405403 1022059484 /nfs/dbraw/zinc/05/94/84/1022059484.db2.gz DNDZQSRTUKLIQE-AWEZNQCLSA-N 1 1 341.249 4.368 20 5 EIBDMO Cc1ccc(CNCc2cccc(C[N@@H+](C)C(C)C)c2)cc1[N+](=O)[O-] ZINC000236665930 1022192210 /nfs/dbraw/zinc/19/22/10/1022192210.db2.gz LKPLVGCUBCQNKU-UHFFFAOYSA-N 1 1 341.455 4.033 20 5 EIBDMO Cc1ccc(CNCc2cccc(C[N@H+](C)C(C)C)c2)cc1[N+](=O)[O-] ZINC000236665930 1022192216 /nfs/dbraw/zinc/19/22/16/1022192216.db2.gz LKPLVGCUBCQNKU-UHFFFAOYSA-N 1 1 341.455 4.033 20 5 EIBDMO C[C@H]1CCCC[C@@H]1[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104666739 1022672189 /nfs/dbraw/zinc/67/21/89/1022672189.db2.gz VIGYAQRAMWPCCT-YOEHRIQHSA-N 1 1 343.427 4.303 20 5 EIBDMO CC[C@H]([NH2+]Cc1ccc(Br)o1)c1cccc([N+](=O)[O-])c1 ZINC000188729497 1022772416 /nfs/dbraw/zinc/77/24/16/1022772416.db2.gz KHXCVLQFVMOQPG-ZDUSSCGKSA-N 1 1 339.189 4.191 20 5 EIBDMO Cc1cccc2c1OCC[C@H]2[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000188877777 1022953008 /nfs/dbraw/zinc/95/30/08/1022953008.db2.gz IQUSQOAYUAGKOY-MRXNPFEDSA-N 1 1 332.787 4.170 20 5 EIBDMO Cc1ccc2cc(C[NH2+]Cc3ccc([N+](=O)[O-])cc3Cl)ccc2n1 ZINC000189435633 1023059768 /nfs/dbraw/zinc/05/97/68/1023059768.db2.gz TVAIMCVJDUCQNK-UHFFFAOYSA-N 1 1 341.798 4.395 20 5 EIBDMO CCCc1nc(C)c(C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)o1 ZINC000417325334 1023267638 /nfs/dbraw/zinc/26/76/38/1023267638.db2.gz BVSACFYMAIJNNT-QGZVFWFLSA-N 1 1 343.427 4.401 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@H]1CCOc2c(F)cccc21 ZINC000893910092 1033161816 /nfs/dbraw/zinc/16/18/16/1033161816.db2.gz DQRLDLNOWWXQDW-AWEZNQCLSA-N 1 1 336.750 4.001 20 5 EIBDMO CCC[C@H](C)[C@@H]1CCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000135337350 1023866453 /nfs/dbraw/zinc/86/64/53/1023866453.db2.gz WCQKZVGPNKDVAO-BBRMVZONSA-N 1 1 344.415 4.045 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](c3nc4ccccc4o3)C2)cs1 ZINC000047265870 1023880023 /nfs/dbraw/zinc/88/00/23/1023880023.db2.gz OIGYCSZZMMTKEZ-CYBMUJFWSA-N 1 1 343.408 4.177 20 5 EIBDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000610581326 1024114498 /nfs/dbraw/zinc/11/44/98/1024114498.db2.gz ZUOXHKQSQAHHGO-KRWDZBQOSA-N 1 1 337.379 4.382 20 5 EIBDMO CCOc1cc(C[NH2+][C@](C)(CC)c2nc(C)cs2)ccc1[N+](=O)[O-] ZINC000276929851 1024800532 /nfs/dbraw/zinc/80/05/32/1024800532.db2.gz QSTBMMPJUVLEJG-QGZVFWFLSA-N 1 1 349.456 4.173 20 5 EIBDMO C[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1cccc(N2CCCC2)c1 ZINC000181880531 1025265387 /nfs/dbraw/zinc/26/53/87/1025265387.db2.gz XUXZUHRFVIBRLL-AWEZNQCLSA-N 1 1 343.402 4.185 20 5 EIBDMO Cc1csc(C2([NH2+][C@H]3CCCc4ccc([N+](=O)[O-])cc43)CCC2)n1 ZINC000278891844 1025335389 /nfs/dbraw/zinc/33/53/89/1025335389.db2.gz YPUXXUZMCZRKMV-INIZCTEOSA-N 1 1 343.452 4.406 20 5 EIBDMO CC(C)[N@@H+](C)Cc1ccccc1CNc1ccc(F)cc1[N+](=O)[O-] ZINC000071954790 1025871869 /nfs/dbraw/zinc/87/18/69/1025871869.db2.gz ULFUTDHGMSHIPU-UHFFFAOYSA-N 1 1 331.391 4.186 20 5 EIBDMO Cc1c(C[N@H+](Cc2ccccc2)C[C@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000071958737 1025883679 /nfs/dbraw/zinc/88/36/79/1025883679.db2.gz IYLGCVUBGQQBBW-LJQANCHMSA-N 1 1 340.423 4.084 20 5 EIBDMO COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000051375683 1025951338 /nfs/dbraw/zinc/95/13/38/1025951338.db2.gz RCLGWLJMBCPMBN-MRXNPFEDSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000051375683 1025951349 /nfs/dbraw/zinc/95/13/49/1025951349.db2.gz RCLGWLJMBCPMBN-MRXNPFEDSA-N 1 1 330.359 4.080 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@@H+](C3CC3)C3CCCCC3)c2)cc1 ZINC000728896826 1026191010 /nfs/dbraw/zinc/19/10/10/1026191010.db2.gz MEJQYJSANWPTFV-UHFFFAOYSA-N 1 1 340.427 4.213 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@H](COc3ccccc3)C2)ccc1Cl ZINC000780365346 1026357727 /nfs/dbraw/zinc/35/77/27/1026357727.db2.gz LOLHHSFXZBHWLL-HNNXBMFYSA-N 1 1 346.814 4.149 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](COc3ccccc3)C2)ccc1Cl ZINC000780365346 1026357740 /nfs/dbraw/zinc/35/77/40/1026357740.db2.gz LOLHHSFXZBHWLL-HNNXBMFYSA-N 1 1 346.814 4.149 20 5 EIBDMO COC[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000279733757 1026629265 /nfs/dbraw/zinc/62/92/65/1026629265.db2.gz NVPAARRNJNPJBG-BLLLJJGKSA-N 1 1 334.803 4.287 20 5 EIBDMO COC[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000279733761 1026629899 /nfs/dbraw/zinc/62/98/99/1026629899.db2.gz NVPAARRNJNPJBG-LRDDRELGSA-N 1 1 334.803 4.287 20 5 EIBDMO COc1ccc2c(c1)CCC[C@H]2[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000507140506 1026657909 /nfs/dbraw/zinc/65/79/09/1026657909.db2.gz DWEKCXILDUCPDL-LJQANCHMSA-N 1 1 326.396 4.113 20 5 EIBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccccc1N(C)C ZINC000507170832 1026684551 /nfs/dbraw/zinc/68/45/51/1026684551.db2.gz QMMKMVPOTHKZPT-UHFFFAOYSA-N 1 1 327.428 4.071 20 5 EIBDMO CC[C@@H]1C[C@@]1([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1cccc(C)c1 ZINC000500507080 1026804781 /nfs/dbraw/zinc/80/47/81/1026804781.db2.gz HIROHHCRWBJJAB-BEFAXECRSA-N 1 1 328.387 4.457 20 5 EIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@H](COc2ccccc2)C1 ZINC000507706236 1026882165 /nfs/dbraw/zinc/88/21/65/1026882165.db2.gz GWYQPYMVTCLHPF-QLBOMPFWSA-N 1 1 338.407 4.009 20 5 EIBDMO CC(C)[N@H+](C)Cc1ccccc1CN[C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000178644335 1027072659 /nfs/dbraw/zinc/07/26/59/1027072659.db2.gz LXFLUWZWFGKJIM-MRXNPFEDSA-N 1 1 341.455 4.286 20 5 EIBDMO CC(C)[N@@H+](C)Cc1ccccc1CN[C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000178644335 1027072667 /nfs/dbraw/zinc/07/26/67/1027072667.db2.gz LXFLUWZWFGKJIM-MRXNPFEDSA-N 1 1 341.455 4.286 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](COCc2ccccc2)C1 ZINC000441349277 1027483463 /nfs/dbraw/zinc/48/34/63/1027483463.db2.gz FJDKFFWPMDVSIG-FUHWJXTLSA-N 1 1 340.423 4.195 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000441379198 1027503183 /nfs/dbraw/zinc/50/31/83/1027503183.db2.gz FIAGQGNEDIMUSI-GDBMZVCRSA-N 1 1 328.387 4.360 20 5 EIBDMO Cc1ccc([C@H]2CCC[N@@H+]2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444601427 1027886628 /nfs/dbraw/zinc/88/66/28/1027886628.db2.gz ZRLBUNOIZKUHLG-GOSISDBHSA-N 1 1 336.395 4.117 20 5 EIBDMO Cc1ccc([C@H]2CCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444601427 1027886637 /nfs/dbraw/zinc/88/66/37/1027886637.db2.gz ZRLBUNOIZKUHLG-GOSISDBHSA-N 1 1 336.395 4.117 20 5 EIBDMO Cc1ccccc1[C@@H]1C[N@H+](Cc2cccc([N+](=O)[O-])c2C)[C@@H](C)CO1 ZINC000441436361 1027894448 /nfs/dbraw/zinc/89/44/48/1027894448.db2.gz GQTWKQZNIOIFEW-YWZLYKJASA-N 1 1 340.423 4.174 20 5 EIBDMO Cc1ccccc1[C@@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2C)[C@@H](C)CO1 ZINC000441436361 1027894451 /nfs/dbraw/zinc/89/44/51/1027894451.db2.gz GQTWKQZNIOIFEW-YWZLYKJASA-N 1 1 340.423 4.174 20 5 EIBDMO C[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000444661620 1027932270 /nfs/dbraw/zinc/93/22/70/1027932270.db2.gz IDZKVAFETDMAGP-CXAGYDPISA-N 1 1 329.400 4.260 20 5 EIBDMO CC[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H]1CCCC[C@H]1C ZINC000444666401 1027948501 /nfs/dbraw/zinc/94/85/01/1027948501.db2.gz SHUNGKQTCMAHEO-CZUORRHYSA-N 1 1 344.415 4.045 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCC[C@@H]3/C=C/c3ccccc3)nc2c1 ZINC000444676910 1027957962 /nfs/dbraw/zinc/95/79/62/1027957962.db2.gz RYLZEJFGNACIFY-ROJDOSBLSA-N 1 1 348.406 4.149 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@@H]3/C=C/c3ccccc3)nc2c1 ZINC000444676910 1027957980 /nfs/dbraw/zinc/95/79/80/1027957980.db2.gz RYLZEJFGNACIFY-ROJDOSBLSA-N 1 1 348.406 4.149 20 5 EIBDMO CCC[C@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000536350500 1028091624 /nfs/dbraw/zinc/09/16/24/1028091624.db2.gz XARCASXDDGMSPT-AWEZNQCLSA-N 1 1 329.400 4.262 20 5 EIBDMO CCC[C@@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000536350501 1028093764 /nfs/dbraw/zinc/09/37/64/1028093764.db2.gz XARCASXDDGMSPT-CQSZACIVSA-N 1 1 329.400 4.262 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)c(Cl)c1 ZINC000611790963 1029276237 /nfs/dbraw/zinc/27/62/37/1029276237.db2.gz RLOYAEGNMYHTFS-KRWDZBQOSA-N 1 1 332.787 4.291 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)c(Cl)c1 ZINC000611790963 1029276257 /nfs/dbraw/zinc/27/62/57/1029276257.db2.gz RLOYAEGNMYHTFS-KRWDZBQOSA-N 1 1 332.787 4.291 20 5 EIBDMO CC[C@H](Cc1ccccc1)[N@@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000525127559 1029465919 /nfs/dbraw/zinc/46/59/19/1029465919.db2.gz IGRAJCKDUVYAPV-QGZVFWFLSA-N 1 1 328.412 4.057 20 5 EIBDMO CC(C)c1ccc(C[N@@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000584323633 1029736110 /nfs/dbraw/zinc/73/61/10/1029736110.db2.gz XVTBHMZLYUZJKU-MOPGFXCFSA-N 1 1 344.455 4.252 20 5 EIBDMO CC(C)c1ccc(C[N@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000584323633 1029736116 /nfs/dbraw/zinc/73/61/16/1029736116.db2.gz XVTBHMZLYUZJKU-MOPGFXCFSA-N 1 1 344.455 4.252 20 5 EIBDMO Cc1nc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c(C)s1 ZINC000451543422 1030564440 /nfs/dbraw/zinc/56/44/40/1030564440.db2.gz BLPOURDSEIPEEI-OAHLLOKOSA-N 1 1 331.441 4.048 20 5 EIBDMO CC(=O)c1cccc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000451552194 1030571598 /nfs/dbraw/zinc/57/15/98/1030571598.db2.gz VZDRNRIFFOMKQK-IBGZPJMESA-N 1 1 338.407 4.177 20 5 EIBDMO C[C@@H](C1CC1)[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000170909016 1031055565 /nfs/dbraw/zinc/05/55/65/1031055565.db2.gz DCQGOAYQENPZQK-ZDUSSCGKSA-N 1 1 341.411 4.055 20 5 EIBDMO Cc1c(C[NH2+][C@@H]2CCc3cc(F)c(F)c(F)c32)cccc1[N+](=O)[O-] ZINC000449278888 1031593545 /nfs/dbraw/zinc/59/35/45/1031593545.db2.gz MSNPFGZIIMFZGO-CYBMUJFWSA-N 1 1 336.313 4.098 20 5 EIBDMO Cc1ccc(C[N@H+](Cc2ccc(O)cc2)CC2CC2)cc1[N+](=O)[O-] ZINC000520244643 1031614981 /nfs/dbraw/zinc/61/49/81/1031614981.db2.gz CHIBRWRNFJLVQC-UHFFFAOYSA-N 1 1 326.396 4.021 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000612577462 1031673923 /nfs/dbraw/zinc/67/39/23/1031673923.db2.gz SDQSDZFXGMVKQJ-GOSISDBHSA-N 1 1 328.437 4.193 20 5 EIBDMO CCc1ccc([C@@H]([NH2+]C2CC(C)(F)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453239100 1031761539 /nfs/dbraw/zinc/76/15/39/1031761539.db2.gz PSIJWGXWCJKJTO-VXVMZULRSA-N 1 1 332.375 4.320 20 5 EIBDMO C[N@@H+](CCc1ccc(Br)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000518057997 1033310778 /nfs/dbraw/zinc/31/07/78/1033310778.db2.gz XRHGAGALXUQWAA-UHFFFAOYSA-N 1 1 349.228 4.032 20 5 EIBDMO C[N@H+]1CC[C@H](Nc2nc3ccccc3cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000473518906 1034679250 /nfs/dbraw/zinc/67/92/50/1034679250.db2.gz MYHSLWFUFZJFLR-HKUYNNGSSA-N 1 1 348.406 4.000 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1CSCc2ccccc21 ZINC000595011225 1035505863 /nfs/dbraw/zinc/50/58/63/1035505863.db2.gz CKMXIJAVWKKARP-SJCJKPOMSA-N 1 1 344.436 4.242 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C1(c2cccc(F)c2)CC1 ZINC000595024196 1035511499 /nfs/dbraw/zinc/51/14/99/1035511499.db2.gz YNLMKDLKYCWWGX-GFCCVEGCSA-N 1 1 330.359 4.082 20 5 EIBDMO COc1ccc(C)cc1[C@@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595005075 1035530758 /nfs/dbraw/zinc/53/07/58/1035530758.db2.gz XAGUVZDNYJWTEV-ZIAGYGMSSA-N 1 1 344.411 4.332 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](C)c1ccc(F)cc1F ZINC000595007641 1035531880 /nfs/dbraw/zinc/53/18/80/1035531880.db2.gz PGVIJGPOKPTTIX-GHMZBOCLSA-N 1 1 336.338 4.293 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](c1ncccc1C)C(C)C ZINC000595007721 1035532795 /nfs/dbraw/zinc/53/27/95/1035532795.db2.gz IXMKGUQPHQNQCL-KDOFPFPSSA-N 1 1 343.427 4.355 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H]1CCCOc2ccccc21 ZINC000595036691 1035561017 /nfs/dbraw/zinc/56/10/17/1035561017.db2.gz KMSWWIJSASKVBD-DYVFJYSZSA-N 1 1 342.395 4.168 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CCOc2c(C)cccc21 ZINC000595039112 1035564933 /nfs/dbraw/zinc/56/49/33/1035564933.db2.gz BWENDTUKVLUWCY-SUMWQHHRSA-N 1 1 342.395 4.086 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1cnccc1C(C)(C)C ZINC000595043935 1035568661 /nfs/dbraw/zinc/56/86/61/1035568661.db2.gz BPUXZNQQKABBEC-ZDUSSCGKSA-N 1 1 343.427 4.147 20 5 EIBDMO Cc1noc(C[NH2+][C@@H](CC2CCCC2)c2ccccc2)c1[N+](=O)[O-] ZINC000595421092 1035675882 /nfs/dbraw/zinc/67/58/82/1035675882.db2.gz RGJSDMAWRHGVIN-INIZCTEOSA-N 1 1 329.400 4.302 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H]([C@H]2CCCCO2)C1 ZINC000595789237 1035793520 /nfs/dbraw/zinc/79/35/20/1035793520.db2.gz PVRVJJQIOOMAKW-TXPKVOOTSA-N 1 1 332.444 4.245 20 5 EIBDMO C[C@H]([NH2+][C@H]1CCc2ccccc2-n2ccnc21)c1cccc([N+](=O)[O-])c1 ZINC000596093740 1035821820 /nfs/dbraw/zinc/82/18/20/1035821820.db2.gz FTGNZBSKUYCGIS-KSSFIOAISA-N 1 1 348.406 4.119 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC(C)(C)[C@H]1c1ccncc1 ZINC000596591212 1035907381 /nfs/dbraw/zinc/90/73/81/1035907381.db2.gz IDPWEQCTWLZRHD-RDTXWAMCSA-N 1 1 325.412 4.442 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC(C)(C)[C@H]1c1ccncc1 ZINC000596591212 1035907396 /nfs/dbraw/zinc/90/73/96/1035907396.db2.gz IDPWEQCTWLZRHD-RDTXWAMCSA-N 1 1 325.412 4.442 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)cc(Cl)c1N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000587837747 1036142772 /nfs/dbraw/zinc/14/27/72/1036142772.db2.gz DEEWFFOIJXQZPP-SECBINFHSA-N 1 1 341.198 4.009 20 5 EIBDMO CCC[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)CC1CCCCC1 ZINC000060495759 1036159075 /nfs/dbraw/zinc/15/90/75/1036159075.db2.gz HDOTYPIZVXPBEJ-UHFFFAOYSA-N 1 1 348.443 4.254 20 5 EIBDMO COc1cc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)ccc1[N+](=O)[O-] ZINC000485720867 1036204921 /nfs/dbraw/zinc/20/49/21/1036204921.db2.gz ZBDACPRLIXDWBD-INIZCTEOSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1cc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)ccc1[N+](=O)[O-] ZINC000485720867 1036204944 /nfs/dbraw/zinc/20/49/44/1036204944.db2.gz ZBDACPRLIXDWBD-INIZCTEOSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1cc(C[N@H+](C)[C@@H](C)c2ccccc2Cl)ccc1[N+](=O)[O-] ZINC000485736162 1036229881 /nfs/dbraw/zinc/22/98/81/1036229881.db2.gz HJVKIDIVJGJNIJ-LBPRGKRZSA-N 1 1 334.803 4.450 20 5 EIBDMO COc1cc(C[N@@H+](C)[C@@H](C)c2ccccc2Cl)ccc1[N+](=O)[O-] ZINC000485736162 1036229899 /nfs/dbraw/zinc/22/98/99/1036229899.db2.gz HJVKIDIVJGJNIJ-LBPRGKRZSA-N 1 1 334.803 4.450 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000485797554 1036280024 /nfs/dbraw/zinc/28/00/24/1036280024.db2.gz YMNKDWQRDMYLLR-DNVCBOLYSA-N 1 1 326.396 4.038 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCO[C@@H](c2ccccc2)C1 ZINC000485797554 1036280044 /nfs/dbraw/zinc/28/00/44/1036280044.db2.gz YMNKDWQRDMYLLR-DNVCBOLYSA-N 1 1 326.396 4.038 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@H](C)c1ccc(F)cc1 ZINC000485801627 1036283739 /nfs/dbraw/zinc/28/37/39/1036283739.db2.gz PULRKURPAUNXDM-CYBMUJFWSA-N 1 1 332.375 4.326 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@@H](C4CC4)C3)cs2)c1 ZINC000589209293 1036711110 /nfs/dbraw/zinc/71/11/10/1036711110.db2.gz BYKIDDMQEHNUEH-OAHLLOKOSA-N 1 1 343.452 4.340 20 5 EIBDMO C[C@@H](C[N@@H+](C)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)(C)C ZINC000603057004 1036715156 /nfs/dbraw/zinc/71/51/56/1036715156.db2.gz YBAOMPHPVZFQBZ-QWHCGFSZSA-N 1 1 346.431 4.320 20 5 EIBDMO CC[NH+](CC)[C@@H](CNCc1ccc(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000061015201 1036770271 /nfs/dbraw/zinc/77/02/71/1036770271.db2.gz VZJVTLJXTPZBSA-FQEVSTJZSA-N 1 1 341.455 4.076 20 5 EIBDMO CC1(C)C[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)c2cc(F)ccc2O1 ZINC000593674348 1036874872 /nfs/dbraw/zinc/87/48/72/1036874872.db2.gz QFFMPOIRRKDZLY-ZDUSSCGKSA-N 1 1 336.388 4.187 20 5 EIBDMO CN(Cc1ccccc1[N+](=O)[O-])c1cc[nH+]c2cc(Cl)ccc21 ZINC000603579594 1036893005 /nfs/dbraw/zinc/89/30/05/1036893005.db2.gz QAKVPQGHDMBVKO-UHFFFAOYSA-N 1 1 327.771 4.433 20 5 EIBDMO CC[N@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)Cc1ccccc1Cl ZINC000603846694 1037039494 /nfs/dbraw/zinc/03/94/94/1037039494.db2.gz LZVSSISLEIJZJJ-UHFFFAOYSA-N 1 1 334.803 4.279 20 5 EIBDMO CC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)Cc1ccccc1Cl ZINC000603846694 1037039515 /nfs/dbraw/zinc/03/95/15/1037039515.db2.gz LZVSSISLEIJZJJ-UHFFFAOYSA-N 1 1 334.803 4.279 20 5 EIBDMO O=[N+]([O-])c1cccc(OCC[N@@H+](Cc2ccco2)C2CCCC2)c1 ZINC000603855367 1037051560 /nfs/dbraw/zinc/05/15/60/1037051560.db2.gz OFTSQOUJMWJUQT-UHFFFAOYSA-N 1 1 330.384 4.011 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CC(C(F)F)C3)o2)c(Cl)c1 ZINC000590968832 1037219074 /nfs/dbraw/zinc/21/90/74/1037219074.db2.gz XHSGUXQQXFBWJF-UHFFFAOYSA-N 1 1 342.729 4.205 20 5 EIBDMO CC(C)(C)c1ncc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000183802806 1037245282 /nfs/dbraw/zinc/24/52/82/1037245282.db2.gz VQSAAUQROVRRBI-UHFFFAOYSA-N 1 1 339.848 4.292 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@@H]2CCC3(CCCC3)O2)C2CC2)cc1 ZINC000570025191 1037379302 /nfs/dbraw/zinc/37/93/02/1037379302.db2.gz XBDMBPDMQAVHQO-SFHVURJKSA-N 1 1 330.428 4.051 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@]1(c2ccc(Cl)cc2)C[C@H]1C ZINC000503403015 1037737023 /nfs/dbraw/zinc/73/70/23/1037737023.db2.gz CQTTXIPVPUMKNZ-KZULUSFZSA-N 1 1 346.814 4.282 20 5 EIBDMO CC(C)c1ccc(C[N@H+]2CC3(C[C@H]2C)CCOCC3)cc1[N+](=O)[O-] ZINC000592529448 1037825395 /nfs/dbraw/zinc/82/53/95/1037825395.db2.gz ZSTKHHDTTLTDRC-OAHLLOKOSA-N 1 1 332.444 4.109 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](Nc2ccccc2)C1 ZINC000489975393 1038293755 /nfs/dbraw/zinc/29/37/55/1038293755.db2.gz DFXYMEBPFGTKIG-DOTOQJQBSA-N 1 1 325.412 4.151 20 5 EIBDMO COc1ccccc1[C@H]1CC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000490034221 1038309740 /nfs/dbraw/zinc/30/97/40/1038309740.db2.gz UQIDPZIJPIELFS-HOTGVXAUSA-N 1 1 340.423 4.462 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CC3(CC3(F)F)C2)s1 ZINC000594609171 1038380419 /nfs/dbraw/zinc/38/04/19/1038380419.db2.gz RJGODTRNYQNVMA-UHFFFAOYSA-N 1 1 336.363 4.164 20 5 EIBDMO COc1cccc(OC)c1C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000594968083 1038558788 /nfs/dbraw/zinc/55/87/88/1038558788.db2.gz MZYXXNALMQLGKC-UHFFFAOYSA-N 1 1 344.411 4.025 20 5 EIBDMO C[C@@H]1CC[C@H](C)[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000537619621 1038954587 /nfs/dbraw/zinc/95/45/87/1038954587.db2.gz HQHFWUWTEWNRTK-OLZOCXBDSA-N 1 1 331.441 4.339 20 5 EIBDMO Cc1ccc(C[N@H+]2CCCCC[C@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000505282600 1039188045 /nfs/dbraw/zinc/18/80/45/1039188045.db2.gz BQDOWFOFVPHSRU-SFHVURJKSA-N 1 1 325.412 4.416 20 5 EIBDMO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1CCCc2cccnc21 ZINC000481443977 1039442712 /nfs/dbraw/zinc/44/27/12/1039442712.db2.gz ZUOOBCKEITZWET-GOSISDBHSA-N 1 1 343.402 4.419 20 5 EIBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1CCCc2cccnc21 ZINC000481443977 1039442719 /nfs/dbraw/zinc/44/27/19/1039442719.db2.gz ZUOOBCKEITZWET-GOSISDBHSA-N 1 1 343.402 4.419 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000430105866 1039847304 /nfs/dbraw/zinc/84/73/04/1039847304.db2.gz OVJDESJKJRXZDP-DQXUBXGMSA-N 1 1 337.423 4.476 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000430105866 1039847305 /nfs/dbraw/zinc/84/73/05/1039847305.db2.gz OVJDESJKJRXZDP-DQXUBXGMSA-N 1 1 337.423 4.476 20 5 EIBDMO C[C@H](CCN(C)C)[NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000481951761 1039907745 /nfs/dbraw/zinc/90/77/45/1039907745.db2.gz HFZMTAVWVDUGJS-KGLIPLIRSA-N 1 1 347.484 4.314 20 5 EIBDMO C[C@H](CC[NH+](C)C)N[C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000481951761 1039907756 /nfs/dbraw/zinc/90/77/56/1039907756.db2.gz HFZMTAVWVDUGJS-KGLIPLIRSA-N 1 1 347.484 4.314 20 5 EIBDMO C[C@@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H](C)C1 ZINC000535545428 1040347745 /nfs/dbraw/zinc/34/77/45/1040347745.db2.gz KLRZDAIRDNCPPC-KGLIPLIRSA-N 1 1 329.400 4.118 20 5 EIBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[C@@H](C)C1 ZINC000443063647 1040509799 /nfs/dbraw/zinc/50/97/99/1040509799.db2.gz DLCYPOCNFNAOAV-XJKSGUPXSA-N 1 1 346.452 4.323 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCCc4ccccc4C3)co2)cc1 ZINC000089896656 1040515451 /nfs/dbraw/zinc/51/54/51/1040515451.db2.gz NAYZNCYKKBNYRF-UHFFFAOYSA-N 1 1 349.390 4.198 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCCc4ccccc4C3)co2)cc1 ZINC000089896656 1040515472 /nfs/dbraw/zinc/51/54/72/1040515472.db2.gz NAYZNCYKKBNYRF-UHFFFAOYSA-N 1 1 349.390 4.198 20 5 EIBDMO C[C@@H]1C[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H]1c1ccccc1 ZINC000089908184 1040569136 /nfs/dbraw/zinc/56/91/36/1040569136.db2.gz PDRIEQVUHULFMD-KUHUBIRLSA-N 1 1 349.390 4.443 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H]1c1ccccc1 ZINC000089908184 1040569148 /nfs/dbraw/zinc/56/91/48/1040569148.db2.gz PDRIEQVUHULFMD-KUHUBIRLSA-N 1 1 349.390 4.443 20 5 EIBDMO C[C@H]1C[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H]1c1ccccc1 ZINC000089908185 1040570272 /nfs/dbraw/zinc/57/02/72/1040570272.db2.gz PDRIEQVUHULFMD-LIRRHRJNSA-N 1 1 349.390 4.443 20 5 EIBDMO C[C@H]1C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H]1c1ccccc1 ZINC000089908185 1040570295 /nfs/dbraw/zinc/57/02/95/1040570295.db2.gz PDRIEQVUHULFMD-LIRRHRJNSA-N 1 1 349.390 4.443 20 5 EIBDMO CCSCC[C@@H](C)[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089913167 1040604176 /nfs/dbraw/zinc/60/41/76/1040604176.db2.gz YWSDMVAQEKDXPW-CYBMUJFWSA-N 1 1 349.456 4.213 20 5 EIBDMO C[C@H](c1ccsc1)[NH+]1CCN([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000462446916 1040611799 /nfs/dbraw/zinc/61/17/99/1040611799.db2.gz LZNLTRXTBZFQRC-HUUCEWRRSA-N 1 1 345.468 4.096 20 5 EIBDMO COc1ccc(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000515307205 1040637556 /nfs/dbraw/zinc/63/75/56/1040637556.db2.gz GIRHLJAOZCQDLT-IBGZPJMESA-N 1 1 338.407 4.331 20 5 EIBDMO COc1ccc(C[N@H+]2CC3(CCC3)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000515307205 1040637561 /nfs/dbraw/zinc/63/75/61/1040637561.db2.gz GIRHLJAOZCQDLT-IBGZPJMESA-N 1 1 338.407 4.331 20 5 EIBDMO CCCCO[C@H]1C[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)C1(C)C ZINC001167960104 1040807757 /nfs/dbraw/zinc/80/77/57/1040807757.db2.gz SCCZYVQSLMTJLU-IRXDYDNUSA-N 1 1 338.423 4.150 20 5 EIBDMO C[C@H]1CCSCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000483425030 1040849324 /nfs/dbraw/zinc/84/93/24/1040849324.db2.gz WXBRKWGFRZWBRA-ZDUSSCGKSA-N 1 1 332.425 4.182 20 5 EIBDMO CC[C@@H](NC[C@H]1CCC[N@H+](CC(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000537950559 1040916133 /nfs/dbraw/zinc/91/61/33/1040916133.db2.gz CIDFOVIMDUABCP-VQIMIIECSA-N 1 1 333.476 4.004 20 5 EIBDMO CC[C@@H](NC[C@H]1CCC[N@@H+](CC(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000537950559 1040916151 /nfs/dbraw/zinc/91/61/51/1040916151.db2.gz CIDFOVIMDUABCP-VQIMIIECSA-N 1 1 333.476 4.004 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+]Cc2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000192932884 1040923298 /nfs/dbraw/zinc/92/32/98/1040923298.db2.gz YWJGZFRFPDHPIB-LBPRGKRZSA-N 1 1 327.409 4.364 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCOCC34CCC4)s2)cc1 ZINC000538728461 1041497624 /nfs/dbraw/zinc/49/76/24/1041497624.db2.gz XZZXARRQYTWREH-UHFFFAOYSA-N 1 1 344.436 4.078 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCOCC34CCC4)s2)cc1 ZINC000538728461 1041497632 /nfs/dbraw/zinc/49/76/32/1041497632.db2.gz XZZXARRQYTWREH-UHFFFAOYSA-N 1 1 344.436 4.078 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCS[C@@H]2CCCC[C@@H]21 ZINC000437535028 1041833705 /nfs/dbraw/zinc/83/37/05/1041833705.db2.gz KFKWOFLDQSFYPX-DZGCQCFKSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCS[C@@H]2CCCC[C@@H]21 ZINC000437535028 1041833708 /nfs/dbraw/zinc/83/37/08/1041833708.db2.gz KFKWOFLDQSFYPX-DZGCQCFKSA-N 1 1 326.849 4.108 20 5 EIBDMO C[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1ccon1 ZINC000541784887 1042119334 /nfs/dbraw/zinc/11/93/34/1042119334.db2.gz ZORCWPBFFILIRN-NSHDSACASA-N 1 1 329.381 4.162 20 5 EIBDMO C[C@H]1C[C@H](c2ccccc2F)[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000464729242 1042143348 /nfs/dbraw/zinc/14/33/48/1042143348.db2.gz DDMQSTAPTZYJBE-KBXCAEBGSA-N 1 1 344.386 4.196 20 5 EIBDMO CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H](C)Cc1ccc(OC)cc1 ZINC000506418510 1042394722 /nfs/dbraw/zinc/39/47/22/1042394722.db2.gz YXUDKGMZQWTAJV-OAHLLOKOSA-N 1 1 328.412 4.057 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H]1CCCc2ccccc21 ZINC000015291623 1042615672 /nfs/dbraw/zinc/61/56/72/1042615672.db2.gz KPERQMLBOFQQMM-SFHVURJKSA-N 1 1 326.396 4.113 20 5 EIBDMO CCOc1cc(C[N@@H+](C)[C@H](C)c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000492377856 1042628350 /nfs/dbraw/zinc/62/83/50/1042628350.db2.gz QTLSBJKCIXLLFL-CYBMUJFWSA-N 1 1 332.375 4.326 20 5 EIBDMO CCOc1cc(C[N@@H+](Cc2cccs2)C(C)C)ccc1[N+](=O)[O-] ZINC000492486339 1042675731 /nfs/dbraw/zinc/67/57/31/1042675731.db2.gz PWQZXRGVYFQQJW-UHFFFAOYSA-N 1 1 334.441 4.466 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2cnc(C(F)(F)F)s2)cc1[N+](=O)[O-] ZINC000443987042 1042725557 /nfs/dbraw/zinc/72/55/57/1042725557.db2.gz IEDJEKFGIWACEV-SECBINFHSA-N 1 1 345.346 4.229 20 5 EIBDMO Cc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cc1Cl ZINC000443990995 1042735611 /nfs/dbraw/zinc/73/56/11/1042735611.db2.gz SQBPGOFCSONMJZ-UHFFFAOYSA-N 1 1 325.195 4.500 20 5 EIBDMO COc1ccc([C@@H]2CC[N@H+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)cc1 ZINC000441535010 1042878520 /nfs/dbraw/zinc/87/85/20/1042878520.db2.gz OKBOXZCWPPBQGD-GDBMZVCRSA-N 1 1 326.396 4.154 20 5 EIBDMO CC(C)CCOC1CC[NH+](Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000493901116 1042980961 /nfs/dbraw/zinc/98/09/61/1042980961.db2.gz RCPIXTFYIUZYOC-UHFFFAOYSA-N 1 1 340.851 4.275 20 5 EIBDMO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000282483255 1043232112 /nfs/dbraw/zinc/23/21/12/1043232112.db2.gz PBWSFIAAUUOYSD-ZDUSSCGKSA-N 1 1 331.416 4.116 20 5 EIBDMO C[C@@H](c1ncc(C(C)(C)C)o1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000282483255 1043232119 /nfs/dbraw/zinc/23/21/19/1043232119.db2.gz PBWSFIAAUUOYSD-ZDUSSCGKSA-N 1 1 331.416 4.116 20 5 EIBDMO O=[N+]([O-])c1ccc(CC[N@@H+](Cc2ccco2)Cc2ccccc2)cc1 ZINC000059384454 1043357662 /nfs/dbraw/zinc/35/76/62/1043357662.db2.gz OJFOISYZNNBCCY-UHFFFAOYSA-N 1 1 336.391 4.433 20 5 EIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC000730062417 1043438460 /nfs/dbraw/zinc/43/84/60/1043438460.db2.gz OGZXKNOJMSNNCJ-INIZCTEOSA-N 1 1 328.387 4.189 20 5 EIBDMO CC[N@H+](CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C(C)C ZINC000520964352 1043465384 /nfs/dbraw/zinc/46/53/84/1043465384.db2.gz UDWQWSJDYBUEOF-UHFFFAOYSA-N 1 1 347.484 4.143 20 5 EIBDMO CC[N@@H+](CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C(C)C ZINC000520964352 1043465388 /nfs/dbraw/zinc/46/53/88/1043465388.db2.gz UDWQWSJDYBUEOF-UHFFFAOYSA-N 1 1 347.484 4.143 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC[C@H]4CCC[C@H]43)o2)c1 ZINC000245450674 1043898892 /nfs/dbraw/zinc/89/88/92/1043898892.db2.gz OVWDZDQDARQAOM-RHSMWYFYSA-N 1 1 341.411 4.057 20 5 EIBDMO Cc1ccc(C[NH2+][C@@H](C)c2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000734163657 1044507923 /nfs/dbraw/zinc/50/79/23/1044507923.db2.gz FBHYROZJKXTTLK-LBPRGKRZSA-N 1 1 327.409 4.364 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2scnc2C2CC2)C2CC2)cc1 ZINC000495066624 1044635074 /nfs/dbraw/zinc/63/50/74/1044635074.db2.gz MGACSCWLKOBQPU-UHFFFAOYSA-N 1 1 329.425 4.093 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2scnc2C2CC2)C2CC2)cc1 ZINC000495066624 1044635086 /nfs/dbraw/zinc/63/50/86/1044635086.db2.gz MGACSCWLKOBQPU-UHFFFAOYSA-N 1 1 329.425 4.093 20 5 EIBDMO C[N@H+]1CCC[C@H](CNc2sccc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000301998249 1044662076 /nfs/dbraw/zinc/66/20/76/1044662076.db2.gz IFRBMDFWHJLNBH-RISCZKNCSA-N 1 1 337.470 4.213 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000075648130 1044871033 /nfs/dbraw/zinc/87/10/33/1044871033.db2.gz URRJZLHJWKBSAP-ZRGWGRIASA-N 1 1 326.396 4.118 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](C)O[C@@H](c2ccccc2)C1 ZINC000075648130 1044871034 /nfs/dbraw/zinc/87/10/34/1044871034.db2.gz URRJZLHJWKBSAP-ZRGWGRIASA-N 1 1 326.396 4.118 20 5 EIBDMO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1cc(Cl)cc2c1OCC2 ZINC000922987835 1044889438 /nfs/dbraw/zinc/88/94/38/1044889438.db2.gz WZANVGQTGFNSIO-SECBINFHSA-N 1 1 338.816 4.095 20 5 EIBDMO Cc1ccc(C[NH2+][C@@H](C)c2nc3c(s2)CCCC3)cc1[N+](=O)[O-] ZINC000736355518 1044928535 /nfs/dbraw/zinc/92/85/35/1044928535.db2.gz QABQVHYIXJELRL-LBPRGKRZSA-N 1 1 331.441 4.089 20 5 EIBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)Cc1ccccn1 ZINC000543623784 1044970330 /nfs/dbraw/zinc/97/03/30/1044970330.db2.gz LHDZFAIWPQYEDI-UHFFFAOYSA-N 1 1 339.420 4.350 20 5 EIBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)Cc1ccccn1 ZINC000543623784 1044970348 /nfs/dbraw/zinc/97/03/48/1044970348.db2.gz LHDZFAIWPQYEDI-UHFFFAOYSA-N 1 1 339.420 4.350 20 5 EIBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CC[C@@H](c3ccc(F)cc3)C2)c(F)c1 ZINC000509391216 1045082414 /nfs/dbraw/zinc/08/24/14/1045082414.db2.gz XVYZCYDNCZKLEZ-GFCCVEGCSA-N 1 1 336.313 4.002 20 5 EIBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CC[C@@H](c3ccc(F)cc3)C2)c(F)c1 ZINC000509391216 1045082429 /nfs/dbraw/zinc/08/24/29/1045082429.db2.gz XVYZCYDNCZKLEZ-GFCCVEGCSA-N 1 1 336.313 4.002 20 5 EIBDMO COc1ncc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1Cl ZINC000611031957 1045245163 /nfs/dbraw/zinc/24/51/63/1045245163.db2.gz RABDRNVYFCLNSZ-UHFFFAOYSA-N 1 1 349.818 4.062 20 5 EIBDMO COc1ncc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1Cl ZINC000611031957 1045245175 /nfs/dbraw/zinc/24/51/75/1045245175.db2.gz RABDRNVYFCLNSZ-UHFFFAOYSA-N 1 1 349.818 4.062 20 5 EIBDMO Cc1ccc(C[N@H+]2CCS[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000611271994 1045270787 /nfs/dbraw/zinc/27/07/87/1045270787.db2.gz FJLGHOJMMYMVMZ-GOSISDBHSA-N 1 1 328.437 4.193 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[NH2+][C@@H](CC3CC3)c3ccccc3)nc2c1 ZINC000611395617 1045300404 /nfs/dbraw/zinc/30/04/04/1045300404.db2.gz KUXDJYBWJBDHSN-INIZCTEOSA-N 1 1 337.379 4.367 20 5 EIBDMO CCc1ccc(C(C)(C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000611398125 1045300833 /nfs/dbraw/zinc/30/08/33/1045300833.db2.gz LDKOLCIQIFOIOU-UHFFFAOYSA-N 1 1 339.395 4.323 20 5 EIBDMO C[C@H]([NH2+]Cc1ccc(CSC(F)F)o1)c1cccc([N+](=O)[O-])c1 ZINC000193901810 1045540021 /nfs/dbraw/zinc/54/00/21/1045540021.db2.gz IZFYJTFFEFLLOK-JTQLQIEISA-N 1 1 342.367 4.494 20 5 EIBDMO CCC1CCC([N@@H+](CCO)Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC001169971715 1045614489 /nfs/dbraw/zinc/61/44/89/1045614489.db2.gz WSKOFELSSGQRIZ-UHFFFAOYSA-N 1 1 340.851 4.011 20 5 EIBDMO C[N@H+](Cc1cccc2cc[nH]c21)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000768215654 1045754806 /nfs/dbraw/zinc/75/48/06/1045754806.db2.gz WBVYGBYMULWPKA-UHFFFAOYSA-N 1 1 329.787 4.362 20 5 EIBDMO C[N@@H+](Cc1cccc2cc[nH]c21)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000768215654 1045754817 /nfs/dbraw/zinc/75/48/17/1045754817.db2.gz WBVYGBYMULWPKA-UHFFFAOYSA-N 1 1 329.787 4.362 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+](Cc2cccc(O)c2)CC2CC2)ccc1Cl ZINC000768541212 1045818555 /nfs/dbraw/zinc/81/85/55/1045818555.db2.gz GHWIYSWFBIHSDT-UHFFFAOYSA-N 1 1 346.814 4.366 20 5 EIBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC001170348041 1046024455 /nfs/dbraw/zinc/02/44/55/1046024455.db2.gz VGIUJLFQDJMDKK-DNVCBOLYSA-N 1 1 340.423 4.372 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cc1C ZINC001170424270 1046119109 /nfs/dbraw/zinc/11/91/09/1046119109.db2.gz LZNBSDCRFWLRRW-GOSISDBHSA-N 1 1 340.423 4.291 20 5 EIBDMO C[C@H]1OCC[C@@]12C[N@@H+](Cc1c3ccccc3cc3ccccc31)CCO2 ZINC000793230987 1046178193 /nfs/dbraw/zinc/17/81/93/1046178193.db2.gz JADHVZCSERKNQR-UZUQRXQVSA-N 1 1 347.458 4.373 20 5 EIBDMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000536669399 1046619599 /nfs/dbraw/zinc/61/95/99/1046619599.db2.gz BBCSBTCDRCCQQG-SWLSCSKDSA-N 1 1 331.441 4.339 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000746663577 1046964409 /nfs/dbraw/zinc/96/44/09/1046964409.db2.gz RHEUJTRBTTUZAD-MRXNPFEDSA-N 1 1 332.787 4.291 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000746663577 1046964394 /nfs/dbraw/zinc/96/43/94/1046964394.db2.gz RHEUJTRBTTUZAD-MRXNPFEDSA-N 1 1 332.787 4.291 20 5 EIBDMO C[C@H]1C[C@H](c2cccnc2)[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000788463353 1047194030 /nfs/dbraw/zinc/19/40/30/1047194030.db2.gz STDCCJBQWUKIGC-BLLLJJGKSA-N 1 1 331.803 4.226 20 5 EIBDMO C[C@H]1C[C@H](c2cccnc2)[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000788463353 1047194021 /nfs/dbraw/zinc/19/40/21/1047194021.db2.gz STDCCJBQWUKIGC-BLLLJJGKSA-N 1 1 331.803 4.226 20 5 EIBDMO CC(C)c1ccc(C[N@H+]2CCC[C@H]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000537468155 1047398247 /nfs/dbraw/zinc/39/82/47/1047398247.db2.gz WIPBWVSECHRJGX-SFHVURJKSA-N 1 1 332.444 4.109 20 5 EIBDMO C[N@@H+](CCCCOC(C)(C)C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000789330782 1047403808 /nfs/dbraw/zinc/40/38/08/1047403808.db2.gz PMNXYLPEKIYHKF-UHFFFAOYSA-N 1 1 328.840 4.275 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(F)c(Cl)cc2F)cc1Cl ZINC000789769906 1047471221 /nfs/dbraw/zinc/47/12/21/1047471221.db2.gz OKGQZCPPUITDTE-UHFFFAOYSA-N 1 1 347.148 4.470 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3ccc4c(c3)COC4)C2)cc1 ZINC000824820819 1047961892 /nfs/dbraw/zinc/96/18/92/1047961892.db2.gz OBCWIZGWJAPHKD-QGZVFWFLSA-N 1 1 338.407 4.005 20 5 EIBDMO C[C@@]1(CCCO)CCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809969729 1048576434 /nfs/dbraw/zinc/57/64/34/1048576434.db2.gz ZJUHGHZHRICYIG-HNNXBMFYSA-N 1 1 347.242 4.029 20 5 EIBDMO C[C@@]1(CCCO)CCC[N@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809969729 1048576443 /nfs/dbraw/zinc/57/64/43/1048576443.db2.gz ZJUHGHZHRICYIG-HNNXBMFYSA-N 1 1 347.242 4.029 20 5 EIBDMO CC[C@@H](O)[C@H]1CCCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809948111 1048578442 /nfs/dbraw/zinc/57/84/42/1048578442.db2.gz UGJLFPQHPADDIN-ZIAGYGMSSA-N 1 1 347.242 4.027 20 5 EIBDMO CC[C@@H](O)[C@H]1CCCC[N@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809948111 1048578457 /nfs/dbraw/zinc/57/84/57/1048578457.db2.gz UGJLFPQHPADDIN-ZIAGYGMSSA-N 1 1 347.242 4.027 20 5 EIBDMO C[N@H+](CCOC(C)(C)C)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809955231 1048581790 /nfs/dbraw/zinc/58/17/90/1048581790.db2.gz SWMBWVHTKNLLLY-UHFFFAOYSA-N 1 1 335.231 4.149 20 5 EIBDMO C[N@@H+](CCOC(C)(C)C)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809955231 1048581807 /nfs/dbraw/zinc/58/18/07/1048581807.db2.gz SWMBWVHTKNLLLY-UHFFFAOYSA-N 1 1 335.231 4.149 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](Oc2ccc(Cl)cc2)C1 ZINC001170594248 1048583775 /nfs/dbraw/zinc/58/37/75/1048583775.db2.gz RZVSYCIPXREJKA-CZUORRHYSA-N 1 1 346.814 4.463 20 5 EIBDMO C[C@H]([NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])c1cccc(O)c1 ZINC000809972804 1048593534 /nfs/dbraw/zinc/59/35/34/1048593534.db2.gz ZBERFVAGLYWLOR-VIFPVBQESA-N 1 1 341.194 4.458 20 5 EIBDMO CO[C@]1(C)CCC[N@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000809999263 1048599992 /nfs/dbraw/zinc/59/99/92/1048599992.db2.gz DLOOJLNXZWOEHH-OAHLLOKOSA-N 1 1 347.242 4.293 20 5 EIBDMO CO[C@]1(C)CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000809999263 1048600002 /nfs/dbraw/zinc/60/00/02/1048600002.db2.gz DLOOJLNXZWOEHH-OAHLLOKOSA-N 1 1 347.242 4.293 20 5 EIBDMO CC[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@H](C)Cc1ccc(OC)cc1 ZINC000609432215 1049061492 /nfs/dbraw/zinc/06/14/92/1049061492.db2.gz UGBDGKVVWURTOM-CQSZACIVSA-N 1 1 346.402 4.196 20 5 EIBDMO O=[N+]([O-])c1ccc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)s1 ZINC000609513066 1049124237 /nfs/dbraw/zinc/12/42/37/1049124237.db2.gz OGTNAASTOUPUHP-MQVJKMGUSA-N 1 1 343.452 4.264 20 5 EIBDMO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000609625740 1049212481 /nfs/dbraw/zinc/21/24/81/1049212481.db2.gz XFBMQZWPLYMKNZ-KRWDZBQOSA-N 1 1 326.396 4.113 20 5 EIBDMO COc1ccccc1[C@@H]1CCCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000609626471 1049212924 /nfs/dbraw/zinc/21/29/24/1049212924.db2.gz ZDTZNFYWOYQMDW-IBGZPJMESA-N 1 1 340.423 4.373 20 5 EIBDMO CN(C)c1cccc([C@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000609846422 1049354573 /nfs/dbraw/zinc/35/45/73/1049354573.db2.gz BYCPZTAHEAYHHP-HXUWFJFHSA-N 1 1 339.439 4.040 20 5 EIBDMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000610002008 1049467863 /nfs/dbraw/zinc/46/78/63/1049467863.db2.gz TUTPRUXSCGAYIM-CJNGLKHVSA-N 1 1 344.415 4.045 20 5 EIBDMO COc1ccc(C[N@H+]2C[C@H](c3ccccc3C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000610001846 1049468475 /nfs/dbraw/zinc/46/84/75/1049468475.db2.gz FSVAOAYWJIJSCN-DOTOQJQBSA-N 1 1 340.423 4.290 20 5 EIBDMO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000610002009 1049469482 /nfs/dbraw/zinc/46/94/82/1049469482.db2.gz TUTPRUXSCGAYIM-CZUORRHYSA-N 1 1 344.415 4.045 20 5 EIBDMO C[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccc(OC(F)F)cc1 ZINC000179604202 1049695091 /nfs/dbraw/zinc/69/50/91/1049695091.db2.gz KSEVEGICSDTFAW-JTQLQIEISA-N 1 1 340.301 4.186 20 5 EIBDMO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000216740766 1049852047 /nfs/dbraw/zinc/85/20/47/1049852047.db2.gz SSRNXUNOXUTESO-QGZVFWFLSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1ccccc1[C@H]1CCC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000216740766 1049852050 /nfs/dbraw/zinc/85/20/50/1049852050.db2.gz SSRNXUNOXUTESO-QGZVFWFLSA-N 1 1 330.359 4.080 20 5 EIBDMO CC[N@@H+](CCC1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1)CC1CC1 ZINC001185922201 1050195177 /nfs/dbraw/zinc/19/51/77/1050195177.db2.gz IXVQQVRZULIJOX-UHFFFAOYSA-N 1 1 349.450 4.072 20 5 EIBDMO COc1ccc([C@@H]2CCC[N@H+]2[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173225491 1050356312 /nfs/dbraw/zinc/35/63/12/1050356312.db2.gz CMGVGEQBMYWUDM-YWZLYKJASA-N 1 1 340.423 4.372 20 5 EIBDMO COc1ccccc1[C@@H]1CCC[N@H+]1[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173228383 1050357490 /nfs/dbraw/zinc/35/74/90/1050357490.db2.gz VUBKVNUUGZEYHH-BEFAXECRSA-N 1 1 340.423 4.372 20 5 EIBDMO COc1ccc([C@@H]2CCC[N@H+]2[C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173225490 1050357786 /nfs/dbraw/zinc/35/77/86/1050357786.db2.gz CMGVGEQBMYWUDM-QRWLVFNGSA-N 1 1 340.423 4.372 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccc(Cl)cc2C1 ZINC001173230703 1050359702 /nfs/dbraw/zinc/35/97/02/1050359702.db2.gz ZNZPZJDNXVLHDL-ZDUSSCGKSA-N 1 1 330.815 4.238 20 5 EIBDMO COc1ccccc1[C@H](C)[N@@H+](C)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173234202 1050362231 /nfs/dbraw/zinc/36/22/31/1050362231.db2.gz PVJXTSDXYMNHDI-CABCVRRESA-N 1 1 328.412 4.227 20 5 EIBDMO Cc1cnc(S[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001186757304 1050407424 /nfs/dbraw/zinc/40/74/24/1050407424.db2.gz QIAYLQOOZOXTKA-MRXNPFEDSA-N 1 1 343.452 4.055 20 5 EIBDMO C[C@@H]1[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)CN1c1ccccc1[N+](=O)[O-] ZINC001186906716 1050446730 /nfs/dbraw/zinc/44/67/30/1050446730.db2.gz VTAFWAZYUPOADS-GVDBMIGSSA-N 1 1 339.439 4.083 20 5 EIBDMO CC(C)c1[nH+]ccn1CCNc1c(Cl)cc([N+](=O)[O-])cc1Cl ZINC001187670188 1050591566 /nfs/dbraw/zinc/59/15/66/1050591566.db2.gz ZUUZFESFAYWOPP-UHFFFAOYSA-N 1 1 343.214 4.334 20 5 EIBDMO Cc1cc(Cl)cc(C)c1C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001180267039 1050941521 /nfs/dbraw/zinc/94/15/21/1050941521.db2.gz MHEONGHPPVWQRP-UHFFFAOYSA-N 1 1 330.815 4.423 20 5 EIBDMO Cc1cc(Cl)cc(C)c1C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001180267039 1050941528 /nfs/dbraw/zinc/94/15/28/1050941528.db2.gz MHEONGHPPVWQRP-UHFFFAOYSA-N 1 1 330.815 4.423 20 5 EIBDMO COc1cc(C[NH2+][C@]2(c3ccccc3)CC2(C)C)c([N+](=O)[O-])cc1F ZINC001174906832 1051240523 /nfs/dbraw/zinc/24/05/23/1051240523.db2.gz CIDPMLLUAKFIOJ-IBGZPJMESA-N 1 1 344.386 4.158 20 5 EIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1csc(C(F)(F)F)c1 ZINC001181697940 1051289756 /nfs/dbraw/zinc/28/97/56/1051289756.db2.gz PLDPXCUGQRRZJQ-UHFFFAOYSA-N 1 1 344.358 4.350 20 5 EIBDMO COc1cc(C)ccc1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001181880184 1051337653 /nfs/dbraw/zinc/33/76/53/1051337653.db2.gz ONOJZNMRDLSJEX-QGZVFWFLSA-N 1 1 340.423 4.291 20 5 EIBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)Cc1ccncc1 ZINC000183746348 1051351889 /nfs/dbraw/zinc/35/18/89/1051351889.db2.gz JCOUBAAXEDPULR-UHFFFAOYSA-N 1 1 339.420 4.350 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCCCC[C@H]1CC(C)C ZINC001191112786 1051353875 /nfs/dbraw/zinc/35/38/75/1051353875.db2.gz PYTCUEPGDVMXBM-INIZCTEOSA-N 1 1 347.459 4.132 20 5 EIBDMO CC[C@]1(C)CCC[N@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC001191215455 1051388433 /nfs/dbraw/zinc/38/84/33/1051388433.db2.gz UIYNDYJOOYCGJS-OAHLLOKOSA-N 1 1 341.249 4.369 20 5 EIBDMO CC[C@]1(C)CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC001191215455 1051388445 /nfs/dbraw/zinc/38/84/45/1051388445.db2.gz UIYNDYJOOYCGJS-OAHLLOKOSA-N 1 1 341.249 4.369 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H](C)C[C@@H]1c1cccc(F)c1 ZINC001191244098 1051409170 /nfs/dbraw/zinc/40/91/70/1051409170.db2.gz GMWNQUJETVYDFE-SCLBCKFNSA-N 1 1 344.386 4.326 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)c1 ZINC001191358542 1051429290 /nfs/dbraw/zinc/42/92/90/1051429290.db2.gz MQAKOFAVRDSBIN-LSDHHAIUSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)c1 ZINC001191358542 1051429296 /nfs/dbraw/zinc/42/92/96/1051429296.db2.gz MQAKOFAVRDSBIN-LSDHHAIUSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCS[C@@H]3CCCC[C@H]32)c(Cl)c1 ZINC001191359335 1051441859 /nfs/dbraw/zinc/44/18/59/1051441859.db2.gz UNZRQPIFMHJUOB-HUUCEWRRSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)c(Cl)c1 ZINC001191359335 1051441864 /nfs/dbraw/zinc/44/18/64/1051441864.db2.gz UNZRQPIFMHJUOB-HUUCEWRRSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2C[C@H]3[C@H](C[C@@H]3c3ccccc3)C2)c1 ZINC001175300515 1051494333 /nfs/dbraw/zinc/49/43/33/1051494333.db2.gz FNFOVAIGBCJOGR-OLMNPRSZSA-N 1 1 342.826 4.484 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](C[C@@H]2CC3(CO2)CCCCC3)C2CC2)c1 ZINC001191681514 1051505694 /nfs/dbraw/zinc/50/56/94/1051505694.db2.gz BSCWHYCMVIQPCV-IBGZPJMESA-N 1 1 344.455 4.299 20 5 EIBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC001191646404 1051508615 /nfs/dbraw/zinc/50/86/15/1051508615.db2.gz LWZIHDPNAUXWTE-SFHVURJKSA-N 1 1 326.371 4.386 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](OC2CCC2)C1 ZINC001182633987 1051654128 /nfs/dbraw/zinc/65/41/28/1051654128.db2.gz HGBBIQFLFMVFJR-ILCZHQDMSA-N 1 1 330.428 4.032 20 5 EIBDMO COc1ccc([C@@H](C)C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC001192390190 1051711111 /nfs/dbraw/zinc/71/11/11/1051711111.db2.gz KYRQYWUDALPCPW-HNNXBMFYSA-N 1 1 340.423 4.372 20 5 EIBDMO Cc1[nH+]ccn1Cc1ccc(Nc2cc([N+](=O)[O-])ccc2F)cc1 ZINC001175736856 1051750979 /nfs/dbraw/zinc/75/09/79/1051750979.db2.gz NFEDCCVHTJXECZ-UHFFFAOYSA-N 1 1 326.331 4.031 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2c3ccccc3cc3ccccc32)CC[S@@](=O)C1 ZINC000763651433 1051812454 /nfs/dbraw/zinc/81/24/54/1051812454.db2.gz ICGHBXJWXPOZNN-VOIUYBSRSA-N 1 1 337.488 4.193 20 5 EIBDMO CCCC1(CCC)CCC[N@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC001175898728 1051834598 /nfs/dbraw/zinc/83/45/98/1051834598.db2.gz WCEQXGBGOCDAOQ-UHFFFAOYSA-N 1 1 347.459 4.277 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](CC[C@@H]2CC2(Cl)Cl)C2CC2)cc1 ZINC001192928167 1051839175 /nfs/dbraw/zinc/83/91/75/1051839175.db2.gz GRWGRVQZHKOGEL-GFCCVEGCSA-N 1 1 329.227 4.143 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@]1(C)Cc1ccccc1 ZINC001193066293 1051860273 /nfs/dbraw/zinc/86/02/73/1051860273.db2.gz BBHJTUPDHRVRAS-HXUWFJFHSA-N 1 1 340.423 4.201 20 5 EIBDMO Cc1csc([C@@H]2CC[N@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC001175946760 1051864218 /nfs/dbraw/zinc/86/42/18/1051864218.db2.gz LWKJQKPKVZFUAQ-ZIAGYGMSSA-N 1 1 331.441 4.219 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](c2nc(C)cs2)C1 ZINC001183671489 1051881689 /nfs/dbraw/zinc/88/16/89/1051881689.db2.gz ILLWEKXQEUVUOU-WDBUWWRISA-N 1 1 343.452 4.253 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1[C@H](C)c1ccccc1 ZINC001176366158 1052043200 /nfs/dbraw/zinc/04/32/00/1052043200.db2.gz XYWLHSQOKKSYBX-DNVCBOLYSA-N 1 1 340.423 4.372 20 5 EIBDMO Cc1cc(Nc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)ncc1[N+](=O)[O-] ZINC001184884472 1052116842 /nfs/dbraw/zinc/11/68/42/1052116842.db2.gz AREDXGICCUPFSH-HNNXBMFYSA-N 1 1 340.427 4.416 20 5 EIBDMO CN(c1ccccc1)c1ccc(C[NH2+]Cc2ccco2)cc1[N+](=O)[O-] ZINC000072712606 1052576127 /nfs/dbraw/zinc/57/61/27/1052576127.db2.gz BAXPPQVKGLWQPP-UHFFFAOYSA-N 1 1 337.379 4.246 20 5 EIBDMO CC(C)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccccc1 ZINC000083132703 1052833123 /nfs/dbraw/zinc/83/31/23/1052833123.db2.gz AVYAHYQDTVJONP-UHFFFAOYSA-N 1 1 325.368 4.147 20 5 EIBDMO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@H](C)c1cccc(O)c1 ZINC000083206496 1052849827 /nfs/dbraw/zinc/84/98/27/1052849827.db2.gz FJXRSQMDILMAMW-GFCCVEGCSA-N 1 1 341.367 4.025 20 5 EIBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@H](C)c1cccc(O)c1 ZINC000083206496 1052849829 /nfs/dbraw/zinc/84/98/29/1052849829.db2.gz FJXRSQMDILMAMW-GFCCVEGCSA-N 1 1 341.367 4.025 20 5 EIBDMO CC(C)[C@@H](O)[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 ZINC000850394967 1053165722 /nfs/dbraw/zinc/16/57/22/1053165722.db2.gz KEZZEHCSVPIWFF-ZWKOTPCHSA-N 1 1 348.830 4.096 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000734839096 1053294787 /nfs/dbraw/zinc/29/47/87/1053294787.db2.gz WJIKGEXXCFIIKI-GFCCVEGCSA-N 1 1 334.778 4.377 20 5 EIBDMO CCOc1cc(C[N@H+]2CCc3ccccc3C2(C)C)ccc1[N+](=O)[O-] ZINC001195384741 1053396364 /nfs/dbraw/zinc/39/63/64/1053396364.db2.gz DHBNLNNMNXVBSG-UHFFFAOYSA-N 1 1 340.423 4.287 20 5 EIBDMO CSC[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000552102477 1053453367 /nfs/dbraw/zinc/45/33/67/1053453367.db2.gz AJEOSGMDJMRNRQ-ZDUSSCGKSA-N 1 1 332.425 4.182 20 5 EIBDMO C[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CCc2ccccc21 ZINC001195809069 1053494731 /nfs/dbraw/zinc/49/47/31/1053494731.db2.gz HAOBDNNRFSIDTI-ZDUSSCGKSA-N 1 1 330.815 4.410 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CCc2ccccc21 ZINC001195809068 1053495459 /nfs/dbraw/zinc/49/54/59/1053495459.db2.gz HAOBDNNRFSIDTI-CYBMUJFWSA-N 1 1 330.815 4.410 20 5 EIBDMO C[C@H]([NH2+]Cc1ccc(OC(F)F)cc1F)c1ccccc1[N+](=O)[O-] ZINC000865520996 1053535374 /nfs/dbraw/zinc/53/53/74/1053535374.db2.gz HMZMNNAYWVKGJD-JTQLQIEISA-N 1 1 340.301 4.186 20 5 EIBDMO Cc1cccc([C@@H]2CCC[N@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1C ZINC000776582771 1053561382 /nfs/dbraw/zinc/56/13/82/1053561382.db2.gz BUIPVLGNLWJTQM-VQTJNVASSA-N 1 1 340.423 4.082 20 5 EIBDMO Cc1ccc([C@H]2CCCC[N@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776585317 1053561952 /nfs/dbraw/zinc/56/19/52/1053561952.db2.gz VFXFPIHOYBUHLF-UXHICEINSA-N 1 1 340.423 4.164 20 5 EIBDMO CC[C@H](CO)[N@@H+](Cc1ccccc1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC001197115543 1053840240 /nfs/dbraw/zinc/84/02/40/1053840240.db2.gz MAVKSHLBQADCCJ-QGZVFWFLSA-N 1 1 348.830 4.021 20 5 EIBDMO Cn1ccnc1[C@H]([NH2+]CCCCC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000552249819 1053843688 /nfs/dbraw/zinc/84/36/88/1053843688.db2.gz LKATTWXDYXYKRE-QGZVFWFLSA-N 1 1 344.459 4.224 20 5 EIBDMO C[N@H+]1CCC[C@@H](CNc2ccccc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000301409065 1053870318 /nfs/dbraw/zinc/87/03/18/1053870318.db2.gz IYWFWXVVBBBEIJ-GUYCJALGSA-N 1 1 331.441 4.151 20 5 EIBDMO Cc1cc(NC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000301402484 1053871530 /nfs/dbraw/zinc/87/15/30/1053871530.db2.gz DBHHFAZWGOOULM-KDOFPFPSSA-N 1 1 345.468 4.460 20 5 EIBDMO CC(C)[N@H+](C)Cc1ccccc1CN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000173320176 1054021035 /nfs/dbraw/zinc/02/10/35/1054021035.db2.gz MVMKMZBKSAXUNB-INIZCTEOSA-N 1 1 341.455 4.286 20 5 EIBDMO CC(C)[N@@H+](C)Cc1ccccc1CN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000173320176 1054021037 /nfs/dbraw/zinc/02/10/37/1054021037.db2.gz MVMKMZBKSAXUNB-INIZCTEOSA-N 1 1 341.455 4.286 20 5 EIBDMO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1cccc(OC(F)F)c1 ZINC000123470891 1054151947 /nfs/dbraw/zinc/15/19/47/1054151947.db2.gz RJTFYKJNXUMTBH-SECBINFHSA-N 1 1 328.340 4.109 20 5 EIBDMO Cc1ccc(C[N@H+]2CCCC[C@@H]2Cc2ccc(O)cc2)cc1[N+](=O)[O-] ZINC001198605165 1054203096 /nfs/dbraw/zinc/20/30/96/1054203096.db2.gz XVMONWBAXMGWFV-GOSISDBHSA-N 1 1 340.423 4.206 20 5 EIBDMO CC[C@H](C[N@@H+](CC)C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000775895281 1054279728 /nfs/dbraw/zinc/27/97/28/1054279728.db2.gz KZCBEYIBUICLPJ-UZLBHIALSA-N 1 1 342.439 4.144 20 5 EIBDMO CC(C)c1ccc(C[NH2+]CC2(N(C)C)CCCCC2)cc1[N+](=O)[O-] ZINC001198908743 1054310771 /nfs/dbraw/zinc/31/07/71/1054310771.db2.gz YCNYAJLPRUUHAQ-UHFFFAOYSA-N 1 1 333.476 4.072 20 5 EIBDMO COc1ccc([C@H](C)[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1F ZINC000872018905 1054335492 /nfs/dbraw/zinc/33/54/92/1054335492.db2.gz QWIMFSLVXDWLBA-WDEREUQCSA-N 1 1 336.338 4.293 20 5 EIBDMO O=c1cc2c(n[nH]1)CC[N@@H+](Cc1c3ccccc3cc3ccccc31)C2 ZINC000775995957 1054435140 /nfs/dbraw/zinc/43/51/40/1054435140.db2.gz OAHBNILVPALFGN-UHFFFAOYSA-N 1 1 341.414 4.047 20 5 EIBDMO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1nc2c(s1)CCCC2 ZINC000173427218 1054938210 /nfs/dbraw/zinc/93/82/10/1054938210.db2.gz KMFLOEXCJHXUKM-VXGBXAGGSA-N 1 1 331.441 4.342 20 5 EIBDMO COCC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccc(C)o1 ZINC000273102610 1055509537 /nfs/dbraw/zinc/50/95/37/1055509537.db2.gz VYOFSIHEFJAPBS-OAHLLOKOSA-N 1 1 338.791 4.017 20 5 EIBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)Nc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000301555412 1055728244 /nfs/dbraw/zinc/72/82/44/1055728244.db2.gz RYFZNFYBMFLHJR-LBPRGKRZSA-N 1 1 340.358 4.401 20 5 EIBDMO C[N@@H+](Cc1sc2ccccc2c1Cl)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169035786 1060591844 /nfs/dbraw/zinc/59/18/44/1060591844.db2.gz CGKHEORLQIZHLI-VXGBXAGGSA-N 1 1 338.860 4.432 20 5 EIBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+](CCc2ccccc2)Cc2ccccc2)C1 ZINC001169039302 1060592683 /nfs/dbraw/zinc/59/26/83/1060592683.db2.gz PKYPRGWLLIOVFM-NHCUHLMSSA-N 1 1 338.451 4.177 20 5 EIBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@@H](c3ccc(Cl)c(Cl)c3)C2)C1 ZINC001169036393 1060593691 /nfs/dbraw/zinc/59/36/91/1060593691.db2.gz OANHWEMVBLKEPF-MRVWCRGKSA-N 1 1 343.254 4.228 20 5 EIBDMO Cc1c(C[N@H+]2C[C@]3(C[C@@H]4CC[C@H]3C4)OC(C)(C)C2)cccc1[N+](=O)[O-] ZINC001169733657 1060937414 /nfs/dbraw/zinc/93/74/14/1060937414.db2.gz NJTNIEUJWWBEBD-SYNHAJSKSA-N 1 1 344.455 4.073 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCCC[C@@H]1c1ccco1 ZINC000078831057 217130481 /nfs/dbraw/zinc/13/04/81/217130481.db2.gz SLCPDCWAKVBHAE-MRXNPFEDSA-N 1 1 330.384 4.314 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCCC[C@@H]1c1ccco1 ZINC000078831057 217130484 /nfs/dbraw/zinc/13/04/84/217130484.db2.gz SLCPDCWAKVBHAE-MRXNPFEDSA-N 1 1 330.384 4.314 20 5 EIBDMO CCC(CC)[N@@H+](CC)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC001194781661 1053089414 /nfs/dbraw/zinc/08/94/14/1053089414.db2.gz HAVHCXIXGKLQNQ-UHFFFAOYSA-N 1 1 329.238 4.368 20 5 EIBDMO CC[C@H](C)[C@H]1CCCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000533289469 1032608432 /nfs/dbraw/zinc/60/84/32/1032608432.db2.gz LOZVYPZBSQJYEB-XJKSGUPXSA-N 1 1 344.415 4.045 20 5 EIBDMO C[C@@H]1CCC[C@H](C)C[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000533432030 1032761438 /nfs/dbraw/zinc/76/14/38/1032761438.db2.gz TZNRYTJPZWDBAJ-LSDHHAIUSA-N 1 1 343.427 4.303 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H](C)c1ccc(F)c(F)c1 ZINC000430216735 1019432002 /nfs/dbraw/zinc/43/20/02/1019432002.db2.gz GHMFNXYWLDXJQO-LLVKDONJSA-N 1 1 336.338 4.075 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H](C)c1ccc(F)c(F)c1 ZINC000430216735 1019432024 /nfs/dbraw/zinc/43/20/24/1019432024.db2.gz GHMFNXYWLDXJQO-LLVKDONJSA-N 1 1 336.338 4.075 20 5 EIBDMO CCOc1ccc([C@H]2CCC[N@H+]2Cc2ccccc2[N+](=O)[O-])cc1 ZINC000015372238 1032845658 /nfs/dbraw/zinc/84/56/58/1032845658.db2.gz FWNUFYJTEBFJRI-GOSISDBHSA-N 1 1 326.396 4.331 20 5 EIBDMO CCSc1cc(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])ccn1 ZINC000275041726 1020011073 /nfs/dbraw/zinc/01/10/73/1020011073.db2.gz HFAUDAURHLOGGL-UHFFFAOYSA-N 1 1 337.832 4.045 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@@H]2c2ccc(C)s2)cc1[N+](=O)[O-] ZINC000261474553 1021035942 /nfs/dbraw/zinc/03/59/42/1021035942.db2.gz KGURWYVQLKNAQM-CQSZACIVSA-N 1 1 332.425 4.310 20 5 EIBDMO CC[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC001167377582 1021841716 /nfs/dbraw/zinc/84/17/16/1021841716.db2.gz VJOPQFOFTCGDSF-LBPRGKRZSA-N 1 1 341.249 4.369 20 5 EIBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000580373545 1021926124 /nfs/dbraw/zinc/92/61/24/1021926124.db2.gz BZZBZKGUJNEUAL-BETUJISGSA-N 1 1 346.349 4.027 20 5 EIBDMO CC[C@H]1CCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000536680623 1021949345 /nfs/dbraw/zinc/94/93/45/1021949345.db2.gz XPASWROXVMKEBO-HNNXBMFYSA-N 1 1 342.443 4.007 20 5 EIBDMO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccncc1)c1cccc([N+](=O)[O-])c1 ZINC000173980873 1021994055 /nfs/dbraw/zinc/99/40/55/1021994055.db2.gz UUXOIVXUMCFYKE-YWZLYKJASA-N 1 1 333.391 4.430 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cccc(C(F)(F)F)n1 ZINC000582587993 1022093607 /nfs/dbraw/zinc/09/36/07/1022093607.db2.gz SWXVCGHCPAQDLU-LLVKDONJSA-N 1 1 339.317 4.168 20 5 EIBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)c1 ZINC001167424406 1022315426 /nfs/dbraw/zinc/31/54/26/1022315426.db2.gz IQKSITBBCZMQOJ-OAHLLOKOSA-N 1 1 346.814 4.117 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(OC2CCCCC2)CC1 ZINC000103471865 1022374545 /nfs/dbraw/zinc/37/45/45/1022374545.db2.gz HLFGGPFZPCMXNX-UHFFFAOYSA-N 1 1 336.407 4.048 20 5 EIBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC001167437080 1022637102 /nfs/dbraw/zinc/63/71/02/1022637102.db2.gz BZJSFYLLCIABAC-SMDDNHRTSA-N 1 1 339.233 4.122 20 5 EIBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC001167437080 1022637124 /nfs/dbraw/zinc/63/71/24/1022637124.db2.gz BZJSFYLLCIABAC-SMDDNHRTSA-N 1 1 339.233 4.122 20 5 EIBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000007335629 1022762563 /nfs/dbraw/zinc/76/25/63/1022762563.db2.gz DWUCKVAOEJHTHG-STQMWFEESA-N 1 1 338.367 4.057 20 5 EIBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000511559408 1022860494 /nfs/dbraw/zinc/86/04/94/1022860494.db2.gz ZPFDMBQDWQUALY-OAHLLOKOSA-N 1 1 332.787 4.074 20 5 EIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000511559408 1022860496 /nfs/dbraw/zinc/86/04/96/1022860496.db2.gz ZPFDMBQDWQUALY-OAHLLOKOSA-N 1 1 332.787 4.074 20 5 EIBDMO CCOc1cc(C[N@@H+](C)C2CCC(F)(F)CC2)ccc1[N+](=O)[O-] ZINC000581256185 1022919883 /nfs/dbraw/zinc/91/98/83/1022919883.db2.gz PDYWYYXSUSHOKD-UHFFFAOYSA-N 1 1 328.359 4.003 20 5 EIBDMO Cc1cccc2c1OCC[C@@H]2[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000188952494 1022970081 /nfs/dbraw/zinc/97/00/81/1022970081.db2.gz ZPOIROXNNQQZRG-INIZCTEOSA-N 1 1 332.787 4.170 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC2(CCOCC2)[C@@H]1C(C)C ZINC000414531804 1023252157 /nfs/dbraw/zinc/25/21/57/1023252157.db2.gz CVHQFVPASMIICB-SKTWIKFTSA-N 1 1 344.455 4.135 20 5 EIBDMO CCc1cnc(C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)s1 ZINC000417314569 1023259483 /nfs/dbraw/zinc/25/94/83/1023259483.db2.gz RJYUCXAHGNVGET-MRXNPFEDSA-N 1 1 331.441 4.171 20 5 EIBDMO CCC[C@H]([NH2+]Cc1cn2c(cccc2C)n1)c1cccc([N+](=O)[O-])c1 ZINC000178059373 1023358951 /nfs/dbraw/zinc/35/89/51/1023358951.db2.gz BHPXHJUCAUQJLD-SFHVURJKSA-N 1 1 338.411 4.182 20 5 EIBDMO Cc1ccc2c(ccnc2NCCC[N@@H+]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC001167751721 1023622405 /nfs/dbraw/zinc/62/24/05/1023622405.db2.gz NTNMCYJCURZPDF-OAHLLOKOSA-N 1 1 342.443 4.128 20 5 EIBDMO Cc1nc(C)c(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])s1 ZINC000290324136 1023682793 /nfs/dbraw/zinc/68/27/93/1023682793.db2.gz AEVAGMVTTHHDSY-UHFFFAOYSA-N 1 1 346.239 4.265 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH+]2CCC3(CCC3)CC2)ccc1Br ZINC000308738186 1024803757 /nfs/dbraw/zinc/80/37/57/1024803757.db2.gz PSMXWGCJMJSEHX-UHFFFAOYSA-N 1 1 339.233 4.123 20 5 EIBDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(c2ccc([N+](=O)[O-])s2)CC1 ZINC000610786821 1024851005 /nfs/dbraw/zinc/85/10/05/1024851005.db2.gz IUVWAZKJFMKGPL-CQSZACIVSA-N 1 1 337.489 4.137 20 5 EIBDMO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000611561494 1025386948 /nfs/dbraw/zinc/38/69/48/1025386948.db2.gz RMIUHHFUJDGHHO-UDGJJRABSA-N 1 1 328.334 4.271 20 5 EIBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N(C)C ZINC000472080534 1025695261 /nfs/dbraw/zinc/69/52/61/1025695261.db2.gz PZRVMSODWXCACF-UGSOOPFHSA-N 1 1 347.846 4.029 20 5 EIBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N(C)C ZINC000472080533 1025695292 /nfs/dbraw/zinc/69/52/92/1025695292.db2.gz PZRVMSODWXCACF-SCLBCKFNSA-N 1 1 347.846 4.029 20 5 EIBDMO CCC[C@@H]([NH2+]CCc1ccc2cn[nH]c2c1)c1cccc([N+](=O)[O-])c1 ZINC000585765594 1025828685 /nfs/dbraw/zinc/82/86/85/1025828685.db2.gz YBGDXOHTZLKOMJ-GOSISDBHSA-N 1 1 338.411 4.145 20 5 EIBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH2+]C1(c2ccccc2)CCOCC1 ZINC000548623214 1025833203 /nfs/dbraw/zinc/83/32/03/1025833203.db2.gz ADKWOWAYRSAIDD-UHFFFAOYSA-N 1 1 346.814 4.044 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(Sc3ccccn3)o2)cc1 ZINC000512053688 1025849604 /nfs/dbraw/zinc/84/96/04/1025849604.db2.gz SOQSKQSZPXMXMB-UHFFFAOYSA-N 1 1 341.392 4.024 20 5 EIBDMO CCc1cnc(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)s1 ZINC000279044510 1026013253 /nfs/dbraw/zinc/01/32/53/1026013253.db2.gz JQNTYVMJXAQSAO-OAHLLOKOSA-N 1 1 331.441 4.126 20 5 EIBDMO CC1(C)C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@H]2CCC[C@@H]21 ZINC000550076125 1026018761 /nfs/dbraw/zinc/01/87/61/1026018761.db2.gz KWNOXLWFSJACMW-IRXDYDNUSA-N 1 1 341.411 4.260 20 5 EIBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1csc(C2CCCC2)n1 ZINC000511062189 1026056074 /nfs/dbraw/zinc/05/60/74/1026056074.db2.gz CLYYVEBRXLQZMN-UHFFFAOYSA-N 1 1 345.468 4.383 20 5 EIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1csc(C2CCCC2)n1 ZINC000511062189 1026056094 /nfs/dbraw/zinc/05/60/94/1026056094.db2.gz CLYYVEBRXLQZMN-UHFFFAOYSA-N 1 1 345.468 4.383 20 5 EIBDMO C[C@@H]1CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000512199876 1026423450 /nfs/dbraw/zinc/42/34/50/1026423450.db2.gz VVDPLQGGXCKGOT-CYBMUJFWSA-N 1 1 331.441 4.340 20 5 EIBDMO C[C@@H](c1ccccc1)[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CC1 ZINC000512266572 1026615062 /nfs/dbraw/zinc/61/50/62/1026615062.db2.gz BMDWQFIMTOUJES-ZDUSSCGKSA-N 1 1 336.395 4.197 20 5 EIBDMO C[C@@H](c1ccccc1)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CC1 ZINC000512266572 1026615069 /nfs/dbraw/zinc/61/50/69/1026615069.db2.gz BMDWQFIMTOUJES-ZDUSSCGKSA-N 1 1 336.395 4.197 20 5 EIBDMO CCCCOc1ncccc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000178650662 1027093088 /nfs/dbraw/zinc/09/30/88/1027093088.db2.gz KOEUMNVTYITSKG-AWEZNQCLSA-N 1 1 329.400 4.020 20 5 EIBDMO CCCCOc1ncccc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000178650678 1027093622 /nfs/dbraw/zinc/09/36/22/1027093622.db2.gz KOEUMNVTYITSKG-CQSZACIVSA-N 1 1 329.400 4.020 20 5 EIBDMO C[C@H](Nc1ccc([N+](=O)[O-])cc1F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000310795437 1027402560 /nfs/dbraw/zinc/40/25/60/1027402560.db2.gz FMJFBTAOYQTWLC-HOCLYGCPSA-N 1 1 343.402 4.056 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](Cc1ccccc1C)C1CC1 ZINC000519909787 1027755569 /nfs/dbraw/zinc/75/55/69/1027755569.db2.gz RGUNEVKQPRYFJJ-UHFFFAOYSA-N 1 1 326.396 4.076 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](Cc1ccccc1C)C1CC1 ZINC000519909787 1027755582 /nfs/dbraw/zinc/75/55/82/1027755582.db2.gz RGUNEVKQPRYFJJ-UHFFFAOYSA-N 1 1 326.396 4.076 20 5 EIBDMO CCOc1ccc(C[N@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000522536600 1027979404 /nfs/dbraw/zinc/97/94/04/1027979404.db2.gz VZJSFKBZJBNETA-UHFFFAOYSA-N 1 1 334.803 4.279 20 5 EIBDMO CCOc1ccc(C[N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000522536600 1027979422 /nfs/dbraw/zinc/97/94/22/1027979422.db2.gz VZJSFKBZJBNETA-UHFFFAOYSA-N 1 1 334.803 4.279 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000441451536 1028007407 /nfs/dbraw/zinc/00/74/07/1028007407.db2.gz NPMZTLRWGBFLDG-INIZCTEOSA-N 1 1 338.835 4.172 20 5 EIBDMO CC(C)[C@H]1CCC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000444749606 1028035926 /nfs/dbraw/zinc/03/59/26/1028035926.db2.gz UBNTYOMNQRJPGN-ZFWWWQNUSA-N 1 1 344.415 4.074 20 5 EIBDMO C[N@H+](Cc1cc(Br)cs1)Cc1cccc([N+](=O)[O-])c1 ZINC000047751314 1028194389 /nfs/dbraw/zinc/19/43/89/1028194389.db2.gz ZGJDSDPENWRBMZ-UHFFFAOYSA-N 1 1 341.230 4.051 20 5 EIBDMO C[N@@H+](Cc1cc(Br)cs1)Cc1cccc([N+](=O)[O-])c1 ZINC000047751314 1028194399 /nfs/dbraw/zinc/19/43/99/1028194399.db2.gz ZGJDSDPENWRBMZ-UHFFFAOYSA-N 1 1 341.230 4.051 20 5 EIBDMO COc1ccc(-c2ccc(CNc3ccc(C)c[nH+]3)o2)c([N+](=O)[O-])c1 ZINC000237440969 1029429691 /nfs/dbraw/zinc/42/96/91/1029429691.db2.gz ZOYQBAJAHXXKSW-UHFFFAOYSA-N 1 1 339.351 4.179 20 5 EIBDMO C[C@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])CC[C@H]1c1ccccc1 ZINC000525123363 1029464060 /nfs/dbraw/zinc/46/40/60/1029464060.db2.gz 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331.441 4.340 20 5 EIBDMO C[C@@H]1C[C@H](C)CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000535545431 1040347485 /nfs/dbraw/zinc/34/74/85/1040347485.db2.gz KLRZDAIRDNCPPC-ZIAGYGMSSA-N 1 1 329.400 4.118 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](Cc1ccccc1)[C@@H](C)C1CC1 ZINC000029842245 1040466074 /nfs/dbraw/zinc/46/60/74/1040466074.db2.gz SFOHJYNGADEHGZ-HNNXBMFYSA-N 1 1 340.423 4.404 20 5 EIBDMO COc1ccc2c(c1)CCC[C@@H]2[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000479556615 1040467671 /nfs/dbraw/zinc/46/76/71/1040467671.db2.gz LTLDRUNILLIJBP-IBGZPJMESA-N 1 1 326.396 4.113 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2ccccc2)[C@H](C)C2CC2)cc1[N+](=O)[O-] ZINC000515256379 1040615994 /nfs/dbraw/zinc/61/59/94/1040615994.db2.gz YIOYKVJOFMUMRW-OAHLLOKOSA-N 1 1 340.423 4.404 20 5 EIBDMO C[N@H+](Cc1ccc(OCC2CC2)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000483174887 1040746251 /nfs/dbraw/zinc/74/62/51/1040746251.db2.gz HCOIORFQEDCNJK-UHFFFAOYSA-N 1 1 326.396 4.016 20 5 EIBDMO C[N@@H+](Cc1ccc(OCC2CC2)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000483174887 1040746265 /nfs/dbraw/zinc/74/62/65/1040746265.db2.gz HCOIORFQEDCNJK-UHFFFAOYSA-N 1 1 326.396 4.016 20 5 EIBDMO C[C@@H]1CCC[N@@H+](CCCCNc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000515550938 1040848158 /nfs/dbraw/zinc/84/81/58/1040848158.db2.gz YWYQQPIIJRRJIG-CYBMUJFWSA-N 1 1 325.840 4.172 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccccc1OC(C)C ZINC000538125408 1041082383 /nfs/dbraw/zinc/08/23/83/1041082383.db2.gz VWMAGTJYMKBBDN-CQSZACIVSA-N 1 1 344.411 4.241 20 5 EIBDMO C[N@H+](CCCOc1cccc(Cl)c1)Cc1csc([N+](=O)[O-])c1 ZINC000515781894 1041101915 /nfs/dbraw/zinc/10/19/15/1041101915.db2.gz FWXCLUJLGKBBSM-UHFFFAOYSA-N 1 1 340.832 4.211 20 5 EIBDMO C[N@@H+](CCCOc1cccc(Cl)c1)Cc1csc([N+](=O)[O-])c1 ZINC000515781894 1041101948 /nfs/dbraw/zinc/10/19/48/1041101948.db2.gz FWXCLUJLGKBBSM-UHFFFAOYSA-N 1 1 340.832 4.211 20 5 EIBDMO COc1ccc(C2([NH2+]Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)cc1 ZINC000538158223 1041102160 /nfs/dbraw/zinc/10/21/60/1041102160.db2.gz DVMTVASGOFDPJA-UHFFFAOYSA-N 1 1 332.787 4.036 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2COc3c2ccc(Cl)c3Cl)cc1 ZINC000516101130 1041395298 /nfs/dbraw/zinc/39/52/98/1041395298.db2.gz FKQNTTXCSFELPE-CYBMUJFWSA-N 1 1 339.178 4.125 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@H](CCO)c1ccccc1 ZINC000470177024 1041550961 /nfs/dbraw/zinc/55/09/61/1041550961.db2.gz OIXIVNKBTCOEQW-MQMQVCBVSA-N 1 1 340.423 4.054 20 5 EIBDMO Cc1c(C[N@H+](C)[C@H]2CCCC[C@H]2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000463451202 1041574319 /nfs/dbraw/zinc/57/43/19/1041574319.db2.gz NJOLLJVUCFXOEO-HIFRSBDPSA-N 1 1 330.350 4.456 20 5 EIBDMO COc1ccc(-c2ccc(CNc3cc(C)cc[nH+]3)o2)c([N+](=O)[O-])c1 ZINC000540808835 1041685277 /nfs/dbraw/zinc/68/52/77/1041685277.db2.gz JJAKLQURBYZGJH-UHFFFAOYSA-N 1 1 339.351 4.179 20 5 EIBDMO Cc1ccc2cc(C[N@@H+]3CCc4ccc([N+](=O)[O-])cc4C3)ccc2n1 ZINC000438119845 1042062587 /nfs/dbraw/zinc/06/25/87/1042062587.db2.gz UQDFQMOGOPSAPE-UHFFFAOYSA-N 1 1 333.391 4.010 20 5 EIBDMO Cc1ccc2cc(C[N@H+]3CCc4ccc([N+](=O)[O-])cc4C3)ccc2n1 ZINC000438119845 1042062589 /nfs/dbraw/zinc/06/25/89/1042062589.db2.gz UQDFQMOGOPSAPE-UHFFFAOYSA-N 1 1 333.391 4.010 20 5 EIBDMO CC(C)(C)[C@@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000542320591 1042387860 /nfs/dbraw/zinc/38/78/60/1042387860.db2.gz QYMKUINNSYEQGW-OAHLLOKOSA-N 1 1 343.427 4.160 20 5 EIBDMO COc1ccccc1C[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)C1CC1 ZINC000506569516 1042619841 /nfs/dbraw/zinc/61/98/41/1042619841.db2.gz BRBCOYYIMLMTRK-UHFFFAOYSA-N 1 1 326.396 4.076 20 5 EIBDMO COc1ccccc1C[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)C1CC1 ZINC000506569516 1042619850 /nfs/dbraw/zinc/61/98/50/1042619850.db2.gz BRBCOYYIMLMTRK-UHFFFAOYSA-N 1 1 326.396 4.076 20 5 EIBDMO CCOc1cc(C[N@@H+](C)[C@@H](C)c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000492377857 1042627870 /nfs/dbraw/zinc/62/78/70/1042627870.db2.gz QTLSBJKCIXLLFL-ZDUSSCGKSA-N 1 1 332.375 4.326 20 5 EIBDMO COc1ccc(C[N@@H+]([C@@H](C)c2ccccc2)C2CC2)cc1[N+](=O)[O-] ZINC000506591939 1042651610 /nfs/dbraw/zinc/65/16/10/1042651610.db2.gz DOARZZYQQWKWBK-AWEZNQCLSA-N 1 1 326.396 4.329 20 5 EIBDMO CCOc1cc(C[N@H+]2CCC[C@H]2c2ccsc2)ccc1[N+](=O)[O-] ZINC000492464381 1042659655 /nfs/dbraw/zinc/65/96/55/1042659655.db2.gz SMPRZPUMAOUKLP-HNNXBMFYSA-N 1 1 332.425 4.392 20 5 EIBDMO CCCOc1ccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000507168387 1042746840 /nfs/dbraw/zinc/74/68/40/1042746840.db2.gz CUOIYJWUXXBZSS-UHFFFAOYSA-N 1 1 344.411 4.024 20 5 EIBDMO CCCOc1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000507168387 1042746846 /nfs/dbraw/zinc/74/68/46/1042746846.db2.gz CUOIYJWUXXBZSS-UHFFFAOYSA-N 1 1 344.411 4.024 20 5 EIBDMO CCC[N@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)C[C@H]1CCCCO1 ZINC000761511677 1042873910 /nfs/dbraw/zinc/87/39/10/1042873910.db2.gz NUQBYDNYODITJH-CQSZACIVSA-N 1 1 326.824 4.029 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](COc3ccccc3)C2)cc1Cl ZINC000761532640 1042877150 /nfs/dbraw/zinc/87/71/50/1042877150.db2.gz MFVZZTKDSREBEJ-HNNXBMFYSA-N 1 1 346.814 4.149 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](COc3ccccc3)C2)cc1Cl ZINC000761532640 1042877156 /nfs/dbraw/zinc/87/71/56/1042877156.db2.gz MFVZZTKDSREBEJ-HNNXBMFYSA-N 1 1 346.814 4.149 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](c2ccccc2)C1 ZINC000520597109 1042919594 /nfs/dbraw/zinc/91/95/94/1042919594.db2.gz VROFOJLMUOEYDY-KRWDZBQOSA-N 1 1 340.423 4.372 20 5 EIBDMO C[C@H]1CCc2nc(C[NH2+]C(C)(C)c3ccc([N+](=O)[O-])cc3)sc2C1 ZINC000152917116 1043019663 /nfs/dbraw/zinc/01/96/63/1043019663.db2.gz PYEVHNYMCYAEOD-LBPRGKRZSA-N 1 1 345.468 4.201 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@@H]3/C=C/c3ccccc3)nc2c1 ZINC000611554678 1043047018 /nfs/dbraw/zinc/04/70/18/1043047018.db2.gz RVMCKORUPPJBLA-ROJDOSBLSA-N 1 1 349.390 4.414 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@H]3/C=C/c3ccccc3)nc2c1 ZINC000611554678 1043047029 /nfs/dbraw/zinc/04/70/29/1043047029.db2.gz RVMCKORUPPJBLA-ROJDOSBLSA-N 1 1 349.390 4.414 20 5 EIBDMO Cc1cnc([C@H]([NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)C2CC2)s1 ZINC000120940771 1043091944 /nfs/dbraw/zinc/09/19/44/1043091944.db2.gz DIWYDOWPGYYLNL-BLLLJJGKSA-N 1 1 331.441 4.470 20 5 EIBDMO CC(C)[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1CCC1 ZINC000077357042 1043292968 /nfs/dbraw/zinc/29/29/68/1043292968.db2.gz YZSCNPOXDNXYCS-UHFFFAOYSA-N 1 1 329.400 4.055 20 5 EIBDMO Cc1csc(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)n1 ZINC000171049572 1043412410 /nfs/dbraw/zinc/41/24/10/1043412410.db2.gz JFHUKMTXLOXVJH-UHFFFAOYSA-N 1 1 345.449 4.378 20 5 EIBDMO Cc1cnn(CCCCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000171920518 1043696119 /nfs/dbraw/zinc/69/61/19/1043696119.db2.gz GCHBGZKZTIGZKE-UHFFFAOYSA-N 1 1 344.459 4.181 20 5 EIBDMO CC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@H](C)Cc1ccc(OC)cc1 ZINC000731355542 1043740181 /nfs/dbraw/zinc/74/01/81/1043740181.db2.gz FENVKUZZYQPOQI-CQSZACIVSA-N 1 1 346.402 4.196 20 5 EIBDMO CCCCOc1ncccc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000173352576 1043914303 /nfs/dbraw/zinc/91/43/03/1043914303.db2.gz VRKBNQOBSXMXFW-AWEZNQCLSA-N 1 1 329.400 4.020 20 5 EIBDMO O=[N+]([O-])c1ccsc1NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000301977713 1044527300 /nfs/dbraw/zinc/52/73/00/1044527300.db2.gz DQPBUZVHADUVQQ-LBPRGKRZSA-N 1 1 337.470 4.042 20 5 EIBDMO C[N@H+]1CCC[C@@H](CNc2sccc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000301998245 1044663370 /nfs/dbraw/zinc/66/33/70/1044663370.db2.gz IFRBMDFWHJLNBH-FZMZJTMJSA-N 1 1 337.470 4.213 20 5 EIBDMO Cc1ccc(OC2CC[NH+](Cc3cc(F)ccc3[N+](=O)[O-])CC2)cc1 ZINC000735079017 1044736983 /nfs/dbraw/zinc/73/69/83/1044736983.db2.gz YMUDWKFWMLUOSL-UHFFFAOYSA-N 1 1 344.386 4.086 20 5 EIBDMO C[C@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000736627149 1044959508 /nfs/dbraw/zinc/95/95/08/1044959508.db2.gz CLFIXOWMOIREBE-GXTWGEPZSA-N 1 1 332.350 4.251 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](c1ccc(C)o1)C1CCC1 ZINC000544573175 1044965672 /nfs/dbraw/zinc/96/56/72/1044965672.db2.gz OKQMXJKJXLAZBU-GOSISDBHSA-N 1 1 330.384 4.136 20 5 EIBDMO Cc1ccccc1[C@@H]1C[C@H](C)[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000738312443 1045056651 /nfs/dbraw/zinc/05/66/51/1045056651.db2.gz OKNJWKLHEWEJSU-LSDHHAIUSA-N 1 1 328.387 4.420 20 5 EIBDMO COc1cc(C[N@@H+](CC(C)C)C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000509386780 1045082356 /nfs/dbraw/zinc/08/23/56/1045082356.db2.gz MSYJOOUOIICLFK-UHFFFAOYSA-N 1 1 346.374 4.071 20 5 EIBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2cc(C)cc(Cl)n2)cc1[N+](=O)[O-] ZINC000282437457 1045235505 /nfs/dbraw/zinc/23/55/05/1045235505.db2.gz DPDNVOAPZSNFFS-GFCCVEGCSA-N 1 1 349.818 4.201 20 5 EIBDMO CC[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@@H]1CCOC1 ZINC000611256609 1045269656 /nfs/dbraw/zinc/26/96/56/1045269656.db2.gz JPRQUJMDDPAZGT-AWEZNQCLSA-N 1 1 346.452 4.182 20 5 EIBDMO Cc1c([C@H](C)[NH2+][C@@H]2COc3c2cccc3Cl)cccc1[N+](=O)[O-] ZINC000611336862 1045282889 /nfs/dbraw/zinc/28/28/89/1045282889.db2.gz ZZDWSQWWDYJUBB-XHDPSFHLSA-N 1 1 332.787 4.341 20 5 EIBDMO C[C@@H]([NH2+]Cc1cocn1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000611474147 1045315884 /nfs/dbraw/zinc/31/58/84/1045315884.db2.gz IKILUBXVOYMCSZ-LLVKDONJSA-N 1 1 329.381 4.162 20 5 EIBDMO CCOC(=O)CC[C@@H]1CCC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000611516767 1045321095 /nfs/dbraw/zinc/32/10/95/1045321095.db2.gz WDUSORJMHCZAKJ-CVEARBPZSA-N 1 1 348.443 4.020 20 5 EIBDMO C[C@H](C1CC1)[N@H+](Cc1c(Br)cccc1[N+](=O)[O-])C1CC1 ZINC000768533501 1045817109 /nfs/dbraw/zinc/81/71/09/1045817109.db2.gz YYRQXQQDFUQJBG-SNVBAGLBSA-N 1 1 339.233 4.120 20 5 EIBDMO C[C@H](C1CC1)[N@@H+](Cc1c(Br)cccc1[N+](=O)[O-])C1CC1 ZINC000768533501 1045817112 /nfs/dbraw/zinc/81/71/12/1045817112.db2.gz YYRQXQQDFUQJBG-SNVBAGLBSA-N 1 1 339.233 4.120 20 5 EIBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1ccc([N+](=O)[O-])c2cnccc12 ZINC000301121240 1045895540 /nfs/dbraw/zinc/89/55/40/1045895540.db2.gz XCXRGUSQDYNXQS-OAHLLOKOSA-N 1 1 342.443 4.210 20 5 EIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CC[C@H](c2c(F)cccc2F)C1 ZINC000769229065 1045897572 /nfs/dbraw/zinc/89/75/72/1045897572.db2.gz UUAVBBDGBSFHJG-NSHDSACASA-N 1 1 336.313 4.002 20 5 EIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@H](c2c(F)cccc2F)C1 ZINC000769229065 1045897577 /nfs/dbraw/zinc/89/75/77/1045897577.db2.gz UUAVBBDGBSFHJG-NSHDSACASA-N 1 1 336.313 4.002 20 5 EIBDMO CC[N@@H+](Cc1cccs1)[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170350936 1046022434 /nfs/dbraw/zinc/02/24/34/1046022434.db2.gz CRVWYOJVGVWDHE-ZDUSSCGKSA-N 1 1 334.441 4.118 20 5 EIBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC001170348148 1046023543 /nfs/dbraw/zinc/02/35/43/1046023543.db2.gz VGIUJLFQDJMDKK-KXBFYZLASA-N 1 1 340.423 4.372 20 5 EIBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cc2ccccc2o1 ZINC000792880556 1046090761 /nfs/dbraw/zinc/09/07/61/1046090761.db2.gz SMJAGDPATNEKPA-NSHDSACASA-N 1 1 341.323 4.100 20 5 EIBDMO CC(C)(C)OC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000272775827 1046122694 /nfs/dbraw/zinc/12/26/94/1046122694.db2.gz GLOWEJYUMLRQSP-UHFFFAOYSA-N 1 1 326.824 4.028 20 5 EIBDMO Cc1ccc(C[N@@H+]2CCC[C@H]2CC(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000770279889 1046167483 /nfs/dbraw/zinc/16/74/83/1046167483.db2.gz FGHPGDRHJBAUKJ-HNNXBMFYSA-N 1 1 344.436 4.202 20 5 EIBDMO Cc1ccc(C[N@H+]2CCC[C@H]2CC(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000770279889 1046167490 /nfs/dbraw/zinc/16/74/90/1046167490.db2.gz FGHPGDRHJBAUKJ-HNNXBMFYSA-N 1 1 344.436 4.202 20 5 EIBDMO Cc1ccc(C[N@@H+]2CCC[C@@H]2CC(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000770279891 1046168136 /nfs/dbraw/zinc/16/81/36/1046168136.db2.gz FGHPGDRHJBAUKJ-OAHLLOKOSA-N 1 1 344.436 4.202 20 5 EIBDMO Cc1ccc(C[N@H+]2CCC[C@@H]2CC(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000770279891 1046168143 /nfs/dbraw/zinc/16/81/43/1046168143.db2.gz FGHPGDRHJBAUKJ-OAHLLOKOSA-N 1 1 344.436 4.202 20 5 EIBDMO C[C@H]1OCC[C@]12C[N@@H+](Cc1c3ccccc3cc3ccccc31)CCO2 ZINC000793230980 1046178160 /nfs/dbraw/zinc/17/81/60/1046178160.db2.gz JADHVZCSERKNQR-HXOBKFHXSA-N 1 1 347.458 4.373 20 5 EIBDMO C[C@@H](CCO)[N@@H+](Cc1ccccc1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000772391107 1046630066 /nfs/dbraw/zinc/63/00/66/1046630066.db2.gz VQEFJGKSHWDVLR-AWEZNQCLSA-N 1 1 348.830 4.021 20 5 EIBDMO C[C@H](CCO)[N@@H+](Cc1ccccc1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000772387381 1046631855 /nfs/dbraw/zinc/63/18/55/1046631855.db2.gz HRYQWKCSNPFPJW-CQSZACIVSA-N 1 1 348.830 4.021 20 5 EIBDMO COc1ccccc1[C@H]1CCC[N@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000536683523 1046683262 /nfs/dbraw/zinc/68/32/62/1046683262.db2.gz YFFFYFWXZUYPQQ-QGZVFWFLSA-N 1 1 326.396 4.249 20 5 EIBDMO Cc1ccc(N2CCC[N@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000917212447 1046815946 /nfs/dbraw/zinc/81/59/46/1046815946.db2.gz SREUAKDWNRTQPJ-KRWDZBQOSA-N 1 1 339.439 4.177 20 5 EIBDMO C[C@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788481040 1047198459 /nfs/dbraw/zinc/19/84/59/1047198459.db2.gz OZRFBGAUOQMYPC-SWLSCSKDSA-N 1 1 332.350 4.251 20 5 EIBDMO C[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1c(F)cccc1Cl ZINC000788665090 1047264955 /nfs/dbraw/zinc/26/49/55/1047264955.db2.gz MFHBSRVXOAQVFU-VHSXEESVSA-N 1 1 337.782 4.381 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](c3ccccc3F)C2)c(Cl)c1 ZINC001170536059 1047518024 /nfs/dbraw/zinc/51/80/24/1047518024.db2.gz KFKKZPHJEKGLRN-LBPRGKRZSA-N 1 1 334.778 4.377 20 5 EIBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)[C@H]1CCOC(C)(C)C1 ZINC000810043996 1048607024 /nfs/dbraw/zinc/60/70/24/1048607024.db2.gz VUWRPJFLGFVTQM-AWEZNQCLSA-N 1 1 326.824 4.028 20 5 EIBDMO COc1ccccc1[C@H]1CCCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000609626472 1049212110 /nfs/dbraw/zinc/21/21/10/1049212110.db2.gz ZDTZNFYWOYQMDW-LJQANCHMSA-N 1 1 340.423 4.373 20 5 EIBDMO COc1ccc([C@H]2CC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)cc1 ZINC000609705148 1049278734 /nfs/dbraw/zinc/27/87/34/1049278734.db2.gz VLDGZCZYSXEPKA-AWEZNQCLSA-N 1 1 346.814 4.246 20 5 EIBDMO C[C@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000609916156 1049394514 /nfs/dbraw/zinc/39/45/14/1049394514.db2.gz BMQUZKWSBIGQRI-JSGCOSHPSA-N 1 1 332.350 4.251 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000609916182 1049395244 /nfs/dbraw/zinc/39/52/44/1049395244.db2.gz DKVNTJKHNYSCQV-GDBMZVCRSA-N 1 1 328.387 4.360 20 5 EIBDMO C[C@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000609916154 1049396956 /nfs/dbraw/zinc/39/69/56/1049396956.db2.gz BMQUZKWSBIGQRI-GXTWGEPZSA-N 1 1 332.350 4.251 20 5 EIBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1N(C)C ZINC000773036638 1049543748 /nfs/dbraw/zinc/54/37/48/1049543748.db2.gz RCNWKJHWSXANBQ-LBPRGKRZSA-N 1 1 333.819 4.165 20 5 EIBDMO CC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@H](C)[C@H](O)c1ccccc1 ZINC000812849678 1049611128 /nfs/dbraw/zinc/61/11/28/1049611128.db2.gz RFAHPSYOPDTLGW-ACJLOTCBSA-N 1 1 348.830 4.192 20 5 EIBDMO CC(=O)N1CCC[N@@H+](Cc2c3ccccc3cc3ccccc32)CC1 ZINC000179813253 1049767897 /nfs/dbraw/zinc/76/78/97/1049767897.db2.gz LSVXCVYJBXINOF-UHFFFAOYSA-N 1 1 332.447 4.047 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CC[C@@H]1CC1(Cl)Cl)C1CC1 ZINC000822771304 1049798872 /nfs/dbraw/zinc/79/88/72/1049798872.db2.gz UJWHYYZYQANIGK-GFCCVEGCSA-N 1 1 329.227 4.143 20 5 EIBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[C@@H]1c1ccccc1 ZINC001171018508 1049851523 /nfs/dbraw/zinc/85/15/23/1049851523.db2.gz PXPINNOUMNDEAI-UXHICEINSA-N 1 1 340.423 4.242 20 5 EIBDMO Cc1csc(C2([NH2+]Cc3ccc(C)c([N+](=O)[O-])c3)CCCC2)n1 ZINC000171842340 1050034318 /nfs/dbraw/zinc/03/43/18/1050034318.db2.gz CEEFWEKDZOEPJE-UHFFFAOYSA-N 1 1 331.441 4.227 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC=C(c2ccc(Cl)nc2)CC1 ZINC000773667093 1050206486 /nfs/dbraw/zinc/20/64/86/1050206486.db2.gz LQSUWPFZWOFVNH-ZDUSSCGKSA-N 1 1 343.814 4.494 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@@H](c3ccccc3)C1)CC2 ZINC001172909592 1050246063 /nfs/dbraw/zinc/24/60/63/1050246063.db2.gz TYMRMBWNTLAFGW-WOJBJXKFSA-N 1 1 336.435 4.332 20 5 EIBDMO Cc1cc([NH+]2CCCCCC2)ccc1Nc1cccnc1[N+](=O)[O-] ZINC001186396622 1050307604 /nfs/dbraw/zinc/30/76/04/1050307604.db2.gz IBALEJJTIBUVFB-UHFFFAOYSA-N 1 1 326.400 4.422 20 5 EIBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNCc2c(C)ccc([N+](=O)[O-])c2C)C1 ZINC001177835699 1050313608 /nfs/dbraw/zinc/31/36/08/1050313608.db2.gz USUVARPHBOTOFY-QGZVFWFLSA-N 1 1 347.503 4.202 20 5 EIBDMO CC[C@@H]1CCCN(C(C)(C)C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)C1 ZINC001177835699 1050313620 /nfs/dbraw/zinc/31/36/20/1050313620.db2.gz USUVARPHBOTOFY-QGZVFWFLSA-N 1 1 347.503 4.202 20 5 EIBDMO CC[N@@H+](Cc1ccccc1)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173184375 1050337618 /nfs/dbraw/zinc/33/76/18/1050337618.db2.gz MGEMGUPQOGTSSF-AWEZNQCLSA-N 1 1 346.402 4.196 20 5 EIBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@@H]2c2ccccc2)c1F ZINC001173196516 1050339750 /nfs/dbraw/zinc/33/97/50/1050339750.db2.gz NEFRFKAKRQPRGC-XJKSGUPXSA-N 1 1 344.386 4.121 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1nc2ccccc2s1 ZINC001173223013 1050354541 /nfs/dbraw/zinc/35/45/41/1050354541.db2.gz WEKAQKMQQJAPNY-ZDUSSCGKSA-N 1 1 341.436 4.268 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](Oc2ccccc2)C1 ZINC001173224947 1050357716 /nfs/dbraw/zinc/35/77/16/1050357716.db2.gz AASMJKPGVIJDIZ-JXFKEZNVSA-N 1 1 340.423 4.069 20 5 EIBDMO CCC[N@@H+](CC)C[C@@H](C)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001186603073 1050375412 /nfs/dbraw/zinc/37/54/12/1050375412.db2.gz ZSWKYFOAFSACNH-LLVKDONJSA-N 1 1 333.354 4.146 20 5 EIBDMO CC[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1OC ZINC000775081542 1050472077 /nfs/dbraw/zinc/47/20/77/1050472077.db2.gz VSMYNEVQJAKKOI-HNNXBMFYSA-N 1 1 334.803 4.498 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)cc1Cl ZINC001179952070 1050829743 /nfs/dbraw/zinc/82/97/43/1050829743.db2.gz OEIMLDINXYJVJU-HNNXBMFYSA-N 1 1 348.805 4.452 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC001179958151 1050846136 /nfs/dbraw/zinc/84/61/36/1050846136.db2.gz VYOJXMDNLHBOPL-KRWDZBQOSA-N 1 1 342.414 4.415 20 5 EIBDMO C[N@H+](Cc1cc2cc(Cl)cnc2o1)Cc1ccccc1[N+](=O)[O-] ZINC001180012263 1050854776 /nfs/dbraw/zinc/85/47/76/1050854776.db2.gz ZBFBJLRROKXALC-UHFFFAOYSA-N 1 1 331.759 4.021 20 5 EIBDMO C[N@@H+](Cc1cc2cc(Cl)cnc2o1)Cc1ccccc1[N+](=O)[O-] ZINC001180012263 1050854783 /nfs/dbraw/zinc/85/47/83/1050854783.db2.gz ZBFBJLRROKXALC-UHFFFAOYSA-N 1 1 331.759 4.021 20 5 EIBDMO CCOc1c(Cl)cccc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC001181153336 1051165762 /nfs/dbraw/zinc/16/57/62/1051165762.db2.gz BLWHPEVIZGACHH-UHFFFAOYSA-N 1 1 348.830 4.321 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@]1(c2ccccc2)CC1(C)C ZINC001174907371 1051241173 /nfs/dbraw/zinc/24/11/73/1051241173.db2.gz LGUQCONAHZYJPY-LJQANCHMSA-N 1 1 326.396 4.018 20 5 EIBDMO C[C@H](c1ccccn1)[N@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000183677384 1051255452 /nfs/dbraw/zinc/25/54/52/1051255452.db2.gz QSSQKQUBMHJYRU-CQSZACIVSA-N 1 1 337.379 4.443 20 5 EIBDMO C[C@H](c1ccccn1)[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000183677384 1051255466 /nfs/dbraw/zinc/25/54/66/1051255466.db2.gz QSSQKQUBMHJYRU-CQSZACIVSA-N 1 1 337.379 4.443 20 5 EIBDMO C[C@@H](c1ccccn1)[N@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000183677365 1051257063 /nfs/dbraw/zinc/25/70/63/1051257063.db2.gz QSSQKQUBMHJYRU-AWEZNQCLSA-N 1 1 337.379 4.443 20 5 EIBDMO C[C@@H](c1ccccn1)[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000183677365 1051257078 /nfs/dbraw/zinc/25/70/78/1051257078.db2.gz QSSQKQUBMHJYRU-AWEZNQCLSA-N 1 1 337.379 4.443 20 5 EIBDMO COc1cc(C[N@H+]2CCC[C@@H](C(C)(C)C)CC2)c([N+](=O)[O-])cc1F ZINC001191021957 1051328279 /nfs/dbraw/zinc/32/82/79/1051328279.db2.gz MRMFKEGHBSHJKQ-CQSZACIVSA-N 1 1 338.423 4.391 20 5 EIBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC001181986883 1051363893 /nfs/dbraw/zinc/36/38/93/1051363893.db2.gz PCWYHUVJHPSVKX-OAHLLOKOSA-N 1 1 328.387 4.340 20 5 EIBDMO CC[C@H](Cc1ccc(C)cc1)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC001191269801 1051413626 /nfs/dbraw/zinc/41/36/26/1051413626.db2.gz WUXOVEMABPSGJI-GOSISDBHSA-N 1 1 342.439 4.235 20 5 EIBDMO CCOc1cc(C[N@@H+](C)Cc2cc3ccccc3o2)ccc1[N+](=O)[O-] ZINC001191465291 1051469988 /nfs/dbraw/zinc/46/99/88/1051469988.db2.gz ZEWTVQRWGZTZAZ-UHFFFAOYSA-N 1 1 340.379 4.372 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCc2ccccc2[C@@H]1C(C)C ZINC001191539292 1051477446 /nfs/dbraw/zinc/47/74/46/1051477446.db2.gz FUWWLRLSOUZBPS-FQEVSTJZSA-N 1 1 340.423 4.359 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2ccccc2)C(C)(C)C)cc1[N+](=O)[O-] ZINC001192052921 1051626409 /nfs/dbraw/zinc/62/64/09/1051626409.db2.gz PYHHRZHYXGEUIT-UHFFFAOYSA-N 1 1 328.412 4.404 20 5 EIBDMO COc1ccccc1CCC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC001192392369 1051721240 /nfs/dbraw/zinc/72/12/40/1051721240.db2.gz XZXMBGMITVAPTG-UHFFFAOYSA-N 1 1 340.423 4.201 20 5 EIBDMO C[C@H](c1ccccc1)[C@@H]1CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001176356847 1052037398 /nfs/dbraw/zinc/03/73/98/1052037398.db2.gz VZAVBHJNEUGKGI-UZLBHIALSA-N 1 1 340.423 4.242 20 5 EIBDMO C[C@@H]1C[C@H](c2ccccc2)[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC001194153148 1052089877 /nfs/dbraw/zinc/08/98/77/1052089877.db2.gz MPCYCBAVWFORTL-KZULUSFZSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@@H]1C[C@H](c2ccccc2)[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC001194153148 1052089886 /nfs/dbraw/zinc/08/98/86/1052089886.db2.gz MPCYCBAVWFORTL-KZULUSFZSA-N 1 1 332.350 4.456 20 5 EIBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCC[C@H]1/C=C\c1ccccc1 ZINC001176639480 1052148371 /nfs/dbraw/zinc/14/83/71/1052148371.db2.gz HNNBBVRHPREXJO-YFWYWMRJSA-N 1 1 326.371 4.412 20 5 EIBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@H]1/C=C\c1ccccc1 ZINC001176639480 1052148379 /nfs/dbraw/zinc/14/83/79/1052148379.db2.gz HNNBBVRHPREXJO-YFWYWMRJSA-N 1 1 326.371 4.412 20 5 EIBDMO CN(CC[C@H]1CCCC[N@H+]1C)c1c(Cl)c(Cl)ccc1[N+](=O)[O-] ZINC001185526820 1052256818 /nfs/dbraw/zinc/25/68/18/1052256818.db2.gz HMWJFMMDFMTZCZ-LLVKDONJSA-N 1 1 346.258 4.212 20 5 EIBDMO CC[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC)c1ccccc1OC ZINC000850423004 1053191976 /nfs/dbraw/zinc/19/19/76/1053191976.db2.gz KRUYSHCPNFDUSR-CXAGYDPISA-N 1 1 344.411 4.414 20 5 EIBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccc(C(F)F)nc1 ZINC000850445204 1053217779 /nfs/dbraw/zinc/21/77/79/1053217779.db2.gz PZYOODUXCRLIFM-VIFPVBQESA-N 1 1 341.745 4.432 20 5 EIBDMO CC1(C)C[C@H](c2ccccc2)[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC001195376236 1053393732 /nfs/dbraw/zinc/39/37/32/1053393732.db2.gz HPBLWFZORYCZAJ-GOSISDBHSA-N 1 1 340.423 4.447 20 5 EIBDMO Cc1cccc([C@H]2CCC[N@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)c1C ZINC000776582768 1053561544 /nfs/dbraw/zinc/56/15/44/1053561544.db2.gz BUIPVLGNLWJTQM-UXHICEINSA-N 1 1 340.423 4.082 20 5 EIBDMO CCC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCc2ccccc21 ZINC000776580320 1053563750 /nfs/dbraw/zinc/56/37/50/1053563750.db2.gz UFFHYEVLTUOMBX-UXHICEINSA-N 1 1 340.423 4.028 20 5 EIBDMO Cn1ccnc1[C@@H]([NH2+]CCCCC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000552249818 1053842116 /nfs/dbraw/zinc/84/21/16/1053842116.db2.gz LKATTWXDYXYKRE-KRWDZBQOSA-N 1 1 344.459 4.224 20 5 EIBDMO C[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])cc2F)[C@H]1c1cccs1 ZINC000301427586 1053925049 /nfs/dbraw/zinc/92/50/49/1053925049.db2.gz PLKQTCYXFUCXKV-PXAZEXFGSA-N 1 1 349.431 4.290 20 5 EIBDMO CC1(C)CC[N@@H+](Cc2cc([O-])ccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC001198201621 1054091465 /nfs/dbraw/zinc/09/14/65/1054091465.db2.gz ANDSGQWVOBHPBE-SFHVURJKSA-N 1 1 340.423 4.316 20 5 EIBDMO C[N@H+]1CCC[C@@H](CNc2cccc(F)c2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000301439315 1054170437 /nfs/dbraw/zinc/17/04/37/1054170437.db2.gz TVCWPBIXJZYKGN-LRDDRELGSA-N 1 1 349.431 4.290 20 5 EIBDMO C[C@H]([NH2+][C@H]1CCCOc2ccccc21)c1c(F)cccc1[N+](=O)[O-] ZINC000872031292 1054346774 /nfs/dbraw/zinc/34/67/74/1054346774.db2.gz NWNDPBTXKPYPIZ-WFASDCNBSA-N 1 1 330.359 4.298 20 5 EIBDMO COC[C@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1SC)c1ccccc1 ZINC000872044851 1054357878 /nfs/dbraw/zinc/35/78/78/1054357878.db2.gz GFONPUSJXBCJGH-GUYCJALGSA-N 1 1 346.452 4.355 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc(OC(F)F)c(F)c1)c1ccccc1[N+](=O)[O-] ZINC000873183835 1054504979 /nfs/dbraw/zinc/50/49/79/1054504979.db2.gz LWGOAZNLFQCAHB-SNVBAGLBSA-N 1 1 340.301 4.186 20 5 EIBDMO Cn1c[nH+]c2cc(NCc3ccc(-c4cccc([N+](=O)[O-])c4)o3)ccc21 ZINC001201114283 1054666220 /nfs/dbraw/zinc/66/62/20/1054666220.db2.gz BQRKICNQBKYRFR-UHFFFAOYSA-N 1 1 348.362 4.354 20 5 EIBDMO Cc1csc([C@@H]2CC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)n1 ZINC000877813931 1055126565 /nfs/dbraw/zinc/12/65/65/1055126565.db2.gz QHOXAHIAQCIGCM-GFCCVEGCSA-N 1 1 337.832 4.003 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)cc1 ZINC000776276633 1055144565 /nfs/dbraw/zinc/14/45/65/1055144565.db2.gz LIDZCJWAZIPJGW-ZWKOTPCHSA-N 1 1 346.814 4.119 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@@H]2c2ccccc2Cl)cc1 ZINC000776278257 1055150604 /nfs/dbraw/zinc/15/06/04/1055150604.db2.gz SRINXRXKZPNFEH-MSOLQXFVSA-N 1 1 346.814 4.119 20 5 EIBDMO Cc1ccc([C@H]2CCC[N@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1C ZINC000776279945 1055150898 /nfs/dbraw/zinc/15/08/98/1055150898.db2.gz VDWYEIWJNPKUAS-WOJBJXKFSA-N 1 1 340.423 4.082 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCCCC[C@@H]2c2ccccc2)cc1 ZINC000776279757 1055153716 /nfs/dbraw/zinc/15/37/16/1055153716.db2.gz YUOPUQMZTAEIDG-UXHICEINSA-N 1 1 340.423 4.246 20 5 EIBDMO C[N@H+]1CCC[C@H](CNc2ccc(F)cc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000301452235 1055218205 /nfs/dbraw/zinc/21/82/05/1055218205.db2.gz XSKIKSHZIURAJH-SJKOYZFVSA-N 1 1 349.431 4.290 20 5 EIBDMO Cc1c([C@@H](C)[NH2+][C@H]2CCCc3cn(C(C)C)nc32)cccc1[N+](=O)[O-] ZINC000765819023 1055564798 /nfs/dbraw/zinc/56/47/98/1055564798.db2.gz PZSGXHLNCWVHHI-PBHICJAKSA-N 1 1 342.443 4.409 20 5 EIBDMO C[C@@H]([NH2+]Cc1cscc1Br)c1cccc([N+](=O)[O-])c1 ZINC000387974828 1056128780 /nfs/dbraw/zinc/12/87/80/1056128780.db2.gz DCLHPRVOWUNJQN-SECBINFHSA-N 1 1 341.230 4.270 20 5 EIBDMO CC[N@@H+]1CCCC[C@H]1C(=O)OCc1nc2ccccc2c2ccccc12 ZINC000745089258 1059722205 /nfs/dbraw/zinc/72/22/05/1059722205.db2.gz QNIQOHJNWMTMEW-NRFANRHFSA-N 1 1 348.446 4.306 20 5 EIBDMO CC[N@H+]1CCCC[C@H]1C(=O)OCc1nc2ccccc2c2ccccc12 ZINC000745089258 1059722239 /nfs/dbraw/zinc/72/22/39/1059722239.db2.gz QNIQOHJNWMTMEW-NRFANRHFSA-N 1 1 348.446 4.306 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC000746115011 1060028542 /nfs/dbraw/zinc/02/85/42/1060028542.db2.gz FKYYXAOHBNVPSC-AWEZNQCLSA-N 1 1 326.396 4.329 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCOC2CCCCCC2)C2CC2)cc1 ZINC001168848073 1060484500 /nfs/dbraw/zinc/48/45/00/1060484500.db2.gz IWUDVNCUQSEZLR-UHFFFAOYSA-N 1 1 332.444 4.299 20 5 EIBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCc3ccccc3[C@@H]2c2ccccc2)C1 ZINC001169033201 1060589172 /nfs/dbraw/zinc/58/91/72/1060589172.db2.gz BIYHWJQPDBYGNP-PBEJRMEISA-N 1 1 336.435 4.080 20 5 EIBDMO CCC1(CC)C[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CCS1 ZINC001169024466 1060602621 /nfs/dbraw/zinc/60/26/21/1060602621.db2.gz NQRIYZKOGVNBCD-UHFFFAOYSA-N 1 1 328.865 4.356 20 5 EIBDMO CCC1(CC)C[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CCS1 ZINC001169024466 1060602636 /nfs/dbraw/zinc/60/26/36/1060602636.db2.gz NQRIYZKOGVNBCD-UHFFFAOYSA-N 1 1 328.865 4.356 20 5 EIBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC001169057111 1060612241 /nfs/dbraw/zinc/61/22/41/1060612241.db2.gz UWFKAZCZFNCUJF-VBNZEHGJSA-N 1 1 342.361 4.288 20 5 EIBDMO CCC(CC)[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000532946717 1032406802 /nfs/dbraw/zinc/40/68/02/1032406802.db2.gz FQKBDQFIQUITDC-UHFFFAOYSA-N 1 1 343.427 4.445 20 5 EIBDMO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)Cc1cccc(O)c1 ZINC000532934222 1032411873 /nfs/dbraw/zinc/41/18/73/1032411873.db2.gz ZGMVOXZOUZCLHK-UHFFFAOYSA-N 1 1 338.363 4.192 20 5 EIBDMO CC1CCC([N@H+](Cc2cccc([N+](=O)[O-])c2)C[C@H]2CCCO2)CC1 ZINC000441431182 1032494498 /nfs/dbraw/zinc/49/44/98/1032494498.db2.gz CIXQFEFSZDJCPE-GXOAENINSA-N 1 1 332.444 4.155 20 5 EIBDMO COc1ccc(-c2ccc(C[NH2+]Cc3ccoc3C)o2)c([N+](=O)[O-])c1 ZINC000608836499 1019141434 /nfs/dbraw/zinc/14/14/34/1019141434.db2.gz NEKNNEOOECPKMP-UHFFFAOYSA-N 1 1 342.351 4.055 20 5 EIBDMO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1OC)c1cc(F)ccc1F ZINC000430203859 1019290937 /nfs/dbraw/zinc/29/09/37/1019290937.db2.gz JOUKHGVQDPVIPE-INIZCTEOSA-N 1 1 336.338 4.123 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@H+]3CCC[C@H]3C3CCC3)c2c1 ZINC000728195783 1019325811 /nfs/dbraw/zinc/32/58/11/1019325811.db2.gz GYDWDFUMMHJAMW-ZDUSSCGKSA-N 1 1 333.413 4.094 20 5 EIBDMO COc1ccc(C[C@H]2CCC[N@@H+](Cc3csc([N+](=O)[O-])c3)C2)cc1 ZINC000610215690 1019389502 /nfs/dbraw/zinc/38/95/02/1019389502.db2.gz VUILFGGCTBEEKY-OAHLLOKOSA-N 1 1 346.452 4.120 20 5 EIBDMO CCc1ccc([C@H](COC)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000165247247 1019993298 /nfs/dbraw/zinc/99/32/98/1019993298.db2.gz QARKOLCXTIYEEJ-CJNGLKHVSA-N 1 1 332.400 4.097 20 5 EIBDMO C[C@@H](C1CC1)[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C1CC1 ZINC001167261596 1020718175 /nfs/dbraw/zinc/71/81/75/1020718175.db2.gz CNFRXBWOBWYPDN-JTQLQIEISA-N 1 1 339.233 4.120 20 5 EIBDMO CCCC[N@H+](Cc1ccccc1F)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001167293802 1020897441 /nfs/dbraw/zinc/89/74/41/1020897441.db2.gz AQIYZFPLJKYNHU-LJQANCHMSA-N 1 1 346.402 4.070 20 5 EIBDMO COc1ccc2c(c1)CCC[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C2 ZINC001167325511 1021118211 /nfs/dbraw/zinc/11/82/11/1021118211.db2.gz CGTMDQHNBWMYDQ-UHFFFAOYSA-N 1 1 346.814 4.205 20 5 EIBDMO COc1ccc2c(c1)CCC[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C2 ZINC001167325511 1021118214 /nfs/dbraw/zinc/11/82/14/1021118214.db2.gz CGTMDQHNBWMYDQ-UHFFFAOYSA-N 1 1 346.814 4.205 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc3cccnc3c2)c(Cl)c1 ZINC000613420286 1021997373 /nfs/dbraw/zinc/99/73/73/1021997373.db2.gz LDBCYCAUOAOGMG-UHFFFAOYSA-N 1 1 327.771 4.086 20 5 EIBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@]1(c2ccccc2)CCCCC1=O ZINC000472601042 1022789622 /nfs/dbraw/zinc/78/96/22/1022789622.db2.gz RHGKBJOOGNOKNV-HXUWFJFHSA-N 1 1 338.407 4.065 20 5 EIBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@]1(c2ccccc2)CCCCC1=O ZINC000472601042 1022789649 /nfs/dbraw/zinc/78/96/49/1022789649.db2.gz RHGKBJOOGNOKNV-HXUWFJFHSA-N 1 1 338.407 4.065 20 5 EIBDMO CC(C)Cn1ccnc1C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417316225 1023254960 /nfs/dbraw/zinc/25/49/60/1023254960.db2.gz UBSWOFXJCITYEC-SFHVURJKSA-N 1 1 342.443 4.005 20 5 EIBDMO COc1ccc2nc(C[NH2+][C@H](C)c3cccc([N+](=O)[O-])c3)sc2c1 ZINC000187419940 1023368711 /nfs/dbraw/zinc/36/87/11/1023368711.db2.gz WGLSBRRRCVSXKT-LLVKDONJSA-N 1 1 343.408 4.064 20 5 EIBDMO CCOc1cc(C[N@H+]2CC[C@H](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC001167482942 1023709367 /nfs/dbraw/zinc/70/93/67/1023709367.db2.gz RNGVNIZEYJZTKX-GOSISDBHSA-N 1 1 340.423 4.058 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc3cc(F)ccc3o2)c(Cl)c1 ZINC000341567014 1023879913 /nfs/dbraw/zinc/87/99/13/1023879913.db2.gz OYLFGNRGBXRYHZ-UHFFFAOYSA-N 1 1 334.734 4.423 20 5 EIBDMO C[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc2c(c1)CCCC2 ZINC000610967005 1023888024 /nfs/dbraw/zinc/88/80/24/1023888024.db2.gz ZGVXCWCHNPOQES-CYBMUJFWSA-N 1 1 328.387 4.464 20 5 EIBDMO C[C@H](c1ccccc1)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CC1 ZINC000610581031 1024113853 /nfs/dbraw/zinc/11/38/53/1024113853.db2.gz ZDTCDRPQOGQRAK-CYBMUJFWSA-N 1 1 337.379 4.462 20 5 EIBDMO C[C@@H](c1ccccc1)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CC1 ZINC000610581032 1024114930 /nfs/dbraw/zinc/11/49/30/1024114930.db2.gz ZDTCDRPQOGQRAK-ZDUSSCGKSA-N 1 1 337.379 4.462 20 5 EIBDMO Cc1ccc(C[N@@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)o1 ZINC000506791650 1025757454 /nfs/dbraw/zinc/75/74/54/1025757454.db2.gz XXIZQJADWSPGMU-UHFFFAOYSA-N 1 1 326.352 4.388 20 5 EIBDMO Cc1ccc(C[N@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)o1 ZINC000506791650 1025757494 /nfs/dbraw/zinc/75/74/94/1025757494.db2.gz XXIZQJADWSPGMU-UHFFFAOYSA-N 1 1 326.352 4.388 20 5 EIBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@@H]1CCCOC1 ZINC000119719393 1025886743 /nfs/dbraw/zinc/88/67/43/1025886743.db2.gz IIHDKNQCJROCFE-AWEZNQCLSA-N 1 1 346.452 4.182 20 5 EIBDMO C[C@@H](c1ccccn1)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000182065920 1026067205 /nfs/dbraw/zinc/06/72/05/1026067205.db2.gz ORWJNKIUWHRVCM-AWEZNQCLSA-N 1 1 337.379 4.443 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](c1ncccc1C)C(C)(C)C ZINC000934288835 1026154963 /nfs/dbraw/zinc/15/49/63/1026154963.db2.gz ZHGONZQHSCXCMF-GOSISDBHSA-N 1 1 343.427 4.184 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](c1ncccc1C)C(C)(C)C ZINC000934290084 1026162634 /nfs/dbraw/zinc/16/26/34/1026162634.db2.gz VVNSVRGEPGQSAB-SFHVURJKSA-N 1 1 343.427 4.184 20 5 EIBDMO CCCCc1nc(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])cs1 ZINC000511074335 1026172212 /nfs/dbraw/zinc/17/22/12/1026172212.db2.gz TZCOKJQWNGDMRP-UHFFFAOYSA-N 1 1 333.457 4.068 20 5 EIBDMO CCCCc1nc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cs1 ZINC000511074335 1026172220 /nfs/dbraw/zinc/17/22/20/1026172220.db2.gz TZCOKJQWNGDMRP-UHFFFAOYSA-N 1 1 333.457 4.068 20 5 EIBDMO CC[N@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])[C@@H](C)c1cccc(O)c1 ZINC000184231244 1026236977 /nfs/dbraw/zinc/23/69/77/1026236977.db2.gz GPSJMDATPGYVMT-LBPRGKRZSA-N 1 1 348.374 4.031 20 5 EIBDMO CC[N@@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])[C@@H](C)c1cccc(O)c1 ZINC000184231244 1026236987 /nfs/dbraw/zinc/23/69/87/1026236987.db2.gz GPSJMDATPGYVMT-LBPRGKRZSA-N 1 1 348.374 4.031 20 5 EIBDMO COc1cc(C[NH2+][C@H](C)c2ccc(C)c(F)c2)c([N+](=O)[O-])cc1F ZINC000184310566 1026413644 /nfs/dbraw/zinc/41/36/44/1026413644.db2.gz PDNASIMRNHCVHB-LLVKDONJSA-N 1 1 336.338 4.041 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)cc(Cl)c1NC[C@H]1CCCn2cc[nH+]c21 ZINC000342779522 1026488768 /nfs/dbraw/zinc/48/87/68/1026488768.db2.gz KRBVJZIFKLUGEE-SECBINFHSA-N 1 1 341.198 4.088 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cc(F)c(F)c(F)c2)C2CC2)c1 ZINC000507176582 1026677356 /nfs/dbraw/zinc/67/73/56/1026677356.db2.gz YLCDVRJLBQWHGR-UHFFFAOYSA-N 1 1 336.313 4.177 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cc(F)c(F)c(F)c2)C2CC2)c1 ZINC000507176582 1026677367 /nfs/dbraw/zinc/67/73/67/1026677367.db2.gz YLCDVRJLBQWHGR-UHFFFAOYSA-N 1 1 336.313 4.177 20 5 EIBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1ccccc1Br ZINC000563418333 1026870206 /nfs/dbraw/zinc/87/02/06/1026870206.db2.gz OGQHRFSMNVBSHO-HNNXBMFYSA-N 1 1 347.212 4.134 20 5 EIBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1ccccc1Br ZINC000563418335 1026870847 /nfs/dbraw/zinc/87/08/47/1026870847.db2.gz OGQHRFSMNVBSHO-OAHLLOKOSA-N 1 1 347.212 4.134 20 5 EIBDMO CC[C@@H](C)[N@@H+](Cc1ccccc1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000507693940 1026875922 /nfs/dbraw/zinc/87/59/22/1026875922.db2.gz MSXFTOQCPGJXTG-OAHLLOKOSA-N 1 1 328.412 4.404 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H]2CCCC[C@@H]21 ZINC000543907228 1027444791 /nfs/dbraw/zinc/44/47/91/1027444791.db2.gz XNOQVEVQOJNUSC-FSPWUOQZSA-N 1 1 341.411 4.260 20 5 EIBDMO C[C@H]1C[C@@H](c2cccc(F)c2)[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000441323759 1027448865 /nfs/dbraw/zinc/44/88/65/1027448865.db2.gz OGEQIEOMXCWLMF-LIRRHRJNSA-N 1 1 328.387 4.360 20 5 EIBDMO COc1ccc(C[N@H+](Cc2ccccc2)CC(C)C)cc1[N+](=O)[O-] ZINC000519907635 1027740525 /nfs/dbraw/zinc/74/05/25/1027740525.db2.gz QGXRQGRUJSNNRC-UHFFFAOYSA-N 1 1 328.412 4.262 20 5 EIBDMO Cc1ccc(Nc2c[nH+]c3ccc(Br)cn23)cc1[N+](=O)[O-] ZINC001213661530 1027786410 /nfs/dbraw/zinc/78/64/10/1027786410.db2.gz LWUCBXHEAQUTKG-UHFFFAOYSA-N 1 1 347.172 4.057 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCC[C@@H]3/C=C\c3ccccc3)nc2c1 ZINC000444676906 1027955154 /nfs/dbraw/zinc/95/51/54/1027955154.db2.gz RYLZEJFGNACIFY-HLRDLLSLSA-N 1 1 348.406 4.149 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@@H]3/C=C\c3ccccc3)nc2c1 ZINC000444676906 1027955173 /nfs/dbraw/zinc/95/51/73/1027955173.db2.gz RYLZEJFGNACIFY-HLRDLLSLSA-N 1 1 348.406 4.149 20 5 EIBDMO Cc1ccc(C)c([C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)[C@H](C)CO2)c1 ZINC000441461895 1028068459 /nfs/dbraw/zinc/06/84/59/1028068459.db2.gz HRTZTGWQBKRZRK-OXQOHEQNSA-N 1 1 340.423 4.174 20 5 EIBDMO Cc1ccc(C)c([C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)[C@H](C)CO2)c1 ZINC000441461895 1028068481 /nfs/dbraw/zinc/06/84/81/1028068481.db2.gz HRTZTGWQBKRZRK-OXQOHEQNSA-N 1 1 340.423 4.174 20 5 EIBDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000536365476 1028157232 /nfs/dbraw/zinc/15/72/32/1028157232.db2.gz LHOJEYGQXNUHDY-DDUZABMNSA-N 1 1 341.411 4.403 20 5 EIBDMO C[C@H]1SCC[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000522835836 1028986886 /nfs/dbraw/zinc/98/68/86/1028986886.db2.gz JGQPICGUEZRUTP-KDOFPFPSSA-N 1 1 328.437 4.273 20 5 EIBDMO C[C@H]1SCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000522835836 1028986909 /nfs/dbraw/zinc/98/69/09/1028986909.db2.gz JGQPICGUEZRUTP-KDOFPFPSSA-N 1 1 328.437 4.273 20 5 EIBDMO C[N@H+](Cc1csc(Br)c1)Cc1cccc([N+](=O)[O-])c1 ZINC000052637836 1029296163 /nfs/dbraw/zinc/29/61/63/1029296163.db2.gz PUNGSAJPSGBITQ-UHFFFAOYSA-N 1 1 341.230 4.051 20 5 EIBDMO C[N@@H+](Cc1csc(Br)c1)Cc1cccc([N+](=O)[O-])c1 ZINC000052637836 1029296178 /nfs/dbraw/zinc/29/61/78/1029296178.db2.gz PUNGSAJPSGBITQ-UHFFFAOYSA-N 1 1 341.230 4.051 20 5 EIBDMO C[C@@H](C1CCCCC1)[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000447397092 1030060308 /nfs/dbraw/zinc/06/03/08/1030060308.db2.gz MQLDJPZPIJJGNR-ZDUSSCGKSA-N 1 1 344.415 4.045 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3ccncc3)C2)c(Cl)c1 ZINC000451007128 1030174965 /nfs/dbraw/zinc/17/49/65/1030174965.db2.gz SOXKPRSDZXQOQG-CQSZACIVSA-N 1 1 331.803 4.023 20 5 EIBDMO COc1cc(C[N@@H+]2[C@H](C)[C@@H](CC(F)(F)F)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000451146787 1030273355 /nfs/dbraw/zinc/27/33/55/1030273355.db2.gz NALIFICDDGZPDZ-DMDPSCGWSA-N 1 1 346.349 4.155 20 5 EIBDMO CCC(=O)c1ccc(Nc2ccc3c(c2)[nH+]c(C)n3C)c([N+](=O)[O-])c1 ZINC000530475588 1030444258 /nfs/dbraw/zinc/44/42/58/1030444258.db2.gz RUQIUBMEGHJBCG-UHFFFAOYSA-N 1 1 338.367 4.126 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3nc4ccccc4o3)C2)cc1 ZINC000451544831 1030561261 /nfs/dbraw/zinc/56/12/61/1030561261.db2.gz FXLZSGSJQNKZCP-OAHLLOKOSA-N 1 1 337.379 4.116 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H]2CCC2CCCCC2)cc1 ZINC001168174907 1030665826 /nfs/dbraw/zinc/66/58/26/1030665826.db2.gz JXDWLAPBXKLFOY-AZUAARDMSA-N 1 1 346.471 4.453 20 5 EIBDMO CO[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000611984157 1030708400 /nfs/dbraw/zinc/70/84/00/1030708400.db2.gz MPXJXCXSCBTPGB-INIZCTEOSA-N 1 1 346.452 4.324 20 5 EIBDMO CC(C)Oc1cccc([C@@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])c1 ZINC000179676804 1031266066 /nfs/dbraw/zinc/26/60/66/1031266066.db2.gz ANKFRGOXJSEUPI-CYBMUJFWSA-N 1 1 332.375 4.372 20 5 EIBDMO CCOc1ccccc1[C@H](CC)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC ZINC000179731465 1031278795 /nfs/dbraw/zinc/27/87/95/1031278795.db2.gz CZVXXDHRBHGNID-KRWDZBQOSA-N 1 1 344.411 4.243 20 5 EIBDMO C[C@@H]([NH2+][C@H]1CCc2cc(F)c(F)c(F)c21)c1ccccc1[N+](=O)[O-] ZINC000449200940 1031544549 /nfs/dbraw/zinc/54/45/49/1031544549.db2.gz FXDFUJZFVQBXDB-RNCFNFMXSA-N 1 1 336.313 4.350 20 5 EIBDMO CCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H](C)c1cc2ccccc2o1 ZINC000472433143 1031570803 /nfs/dbraw/zinc/57/08/03/1031570803.db2.gz NGQFZOJKZUNMJV-CQSZACIVSA-N 1 1 342.399 4.011 20 5 EIBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@H]1C ZINC000449493556 1031789264 /nfs/dbraw/zinc/78/92/64/1031789264.db2.gz FCEZFZBTXWDNNO-CXAGYDPISA-N 1 1 346.452 4.180 20 5 EIBDMO CCO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C ZINC000449495022 1031802897 /nfs/dbraw/zinc/80/28/97/1031802897.db2.gz NTKLNKXAQTXCNX-RDTXWAMCSA-N 1 1 344.411 4.102 20 5 EIBDMO CCO[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H]1C ZINC000449501739 1031810170 /nfs/dbraw/zinc/81/01/70/1031810170.db2.gz WBKZSDDTANMABX-RDTXWAMCSA-N 1 1 344.411 4.102 20 5 EIBDMO Cc1cc(-c2noc([C@@H]3CCC[N@H+]3C3CCCC3)n2)cc([N+](=O)[O-])c1 ZINC000453300695 1031818807 /nfs/dbraw/zinc/81/88/07/1031818807.db2.gz ZKYNYNUGXQJJQV-INIZCTEOSA-N 1 1 342.399 4.033 20 5 EIBDMO CC(C)[N@@H+]1CCC[C@H](CN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433172787 1033992381 /nfs/dbraw/zinc/99/23/81/1033992381.db2.gz DMIDMUCHSUUPFY-BEFAXECRSA-N 1 1 345.487 4.027 20 5 EIBDMO CC(C)[N@H+]1CCC[C@H](CN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433172787 1033992393 /nfs/dbraw/zinc/99/23/93/1033992393.db2.gz DMIDMUCHSUUPFY-BEFAXECRSA-N 1 1 345.487 4.027 20 5 EIBDMO Cc1ccc(C[NH2+]Cc2cc(F)c(Cl)cc2F)cc1[N+](=O)[O-] ZINC000433183391 1034004225 /nfs/dbraw/zinc/00/42/25/1034004225.db2.gz RGLWHXFCSRDNGS-UHFFFAOYSA-N 1 1 326.730 4.125 20 5 EIBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000513479528 1034979620 /nfs/dbraw/zinc/97/96/20/1034979620.db2.gz NGHQYBGJZHLMKB-YCABEKBOSA-N 1 1 340.423 4.180 20 5 EIBDMO COc1ccccc1[C@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595003302 1035523990 /nfs/dbraw/zinc/52/39/90/1035523990.db2.gz GMBCBCHPVMJHNM-QWHCGFSZSA-N 1 1 330.384 4.024 20 5 EIBDMO COc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1F ZINC000595002928 1035526774 /nfs/dbraw/zinc/52/67/74/1035526774.db2.gz BQVOTKVWWUHVFC-VXGBXAGGSA-N 1 1 348.374 4.163 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)c1ccc(F)cc1F ZINC000595007643 1035529410 /nfs/dbraw/zinc/52/94/10/1035529410.db2.gz PGVIJGPOKPTTIX-QWRGUYRKSA-N 1 1 336.338 4.293 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1CCCOc2ccccc21 ZINC000595036688 1035560747 /nfs/dbraw/zinc/56/07/47/1035560747.db2.gz KMSWWIJSASKVBD-CXAGYDPISA-N 1 1 342.395 4.168 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1CCOc2c(C)cccc21 ZINC000595039111 1035564156 /nfs/dbraw/zinc/56/41/56/1035564156.db2.gz BWENDTUKVLUWCY-CXAGYDPISA-N 1 1 342.395 4.086 20 5 EIBDMO Cc1noc(C[N@@H+]2CCCC[C@H]2c2cccc(C)c2C)c1[N+](=O)[O-] ZINC000595330017 1035628788 /nfs/dbraw/zinc/62/87/88/1035628788.db2.gz GTZIGGCWAYTSMQ-INIZCTEOSA-N 1 1 329.400 4.235 20 5 EIBDMO Cc1noc(C[N@H+]2CCCC[C@H]2c2cccc(C)c2C)c1[N+](=O)[O-] ZINC000595330017 1035628799 /nfs/dbraw/zinc/62/87/99/1035628799.db2.gz GTZIGGCWAYTSMQ-INIZCTEOSA-N 1 1 329.400 4.235 20 5 EIBDMO Cc1noc(C[NH2+][C@@H](CC(C)(C)C)c2ccc(F)cc2)c1[N+](=O)[O-] ZINC000595412005 1035674509 /nfs/dbraw/zinc/67/45/09/1035674509.db2.gz KDPALAAHVMTWRF-AWEZNQCLSA-N 1 1 335.379 4.297 20 5 EIBDMO CC[N@@H+](CCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000491002031 1035769897 /nfs/dbraw/zinc/76/98/97/1035769897.db2.gz AGLKPGJAYWHCEX-FQEVSTJZSA-N 1 1 341.455 4.004 20 5 EIBDMO CCC1(CC)CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000595752831 1035785586 /nfs/dbraw/zinc/78/55/86/1035785586.db2.gz PBNNJDRBHOVANZ-UHFFFAOYSA-N 1 1 344.415 4.047 20 5 EIBDMO CC[C@@H](C)[N@@H+](C)CCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491050207 1035794441 /nfs/dbraw/zinc/79/44/41/1035794441.db2.gz GZXUAQCZSXGTHL-OXQOHEQNSA-N 1 1 341.455 4.004 20 5 EIBDMO CC(C)[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCCCC1 ZINC000491184698 1035822709 /nfs/dbraw/zinc/82/27/09/1035822709.db2.gz ASHITKMFHXTWLT-UHFFFAOYSA-N 1 1 344.415 4.188 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000596590300 1035909613 /nfs/dbraw/zinc/90/96/13/1035909613.db2.gz CMAVGXKFAOEDEJ-RDTXWAMCSA-N 1 1 325.412 4.442 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000596590300 1035909637 /nfs/dbraw/zinc/90/96/37/1035909637.db2.gz CMAVGXKFAOEDEJ-RDTXWAMCSA-N 1 1 325.412 4.442 20 5 EIBDMO COc1cc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000485776109 1036255838 /nfs/dbraw/zinc/25/58/38/1036255838.db2.gz WKEKUSHWXODWSV-INIZCTEOSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1cc(C[N@H+]2CCC[C@H]2c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000485776109 1036255850 /nfs/dbraw/zinc/25/58/50/1036255850.db2.gz WKEKUSHWXODWSV-INIZCTEOSA-N 1 1 330.359 4.080 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC000485797557 1036280889 /nfs/dbraw/zinc/28/08/89/1036280889.db2.gz YMNKDWQRDMYLLR-KXBFYZLASA-N 1 1 326.396 4.038 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCO[C@H](c2ccccc2)C1 ZINC000485797557 1036280904 /nfs/dbraw/zinc/28/09/04/1036280904.db2.gz YMNKDWQRDMYLLR-KXBFYZLASA-N 1 1 326.396 4.038 20 5 EIBDMO Cn1cc(C[N@H+]2CCC[C@H]2C(C)(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000513759904 1036821520 /nfs/dbraw/zinc/82/15/20/1036821520.db2.gz HRQWOBBWMVVKFJ-KRWDZBQOSA-N 1 1 342.443 4.006 20 5 EIBDMO CCC[C@@H](C)[C@H]1CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000486780497 1036850340 /nfs/dbraw/zinc/85/03/40/1036850340.db2.gz VMPZCYFKJDFLQR-CZUORRHYSA-N 1 1 344.415 4.045 20 5 EIBDMO CCn1ccc(C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)c1 ZINC000590177151 1037012858 /nfs/dbraw/zinc/01/28/58/1037012858.db2.gz NIJLXEYUYJXHPV-UHFFFAOYSA-N 1 1 341.333 4.067 20 5 EIBDMO CCn1ccc(C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)c1 ZINC000590177151 1037012873 /nfs/dbraw/zinc/01/28/73/1037012873.db2.gz NIJLXEYUYJXHPV-UHFFFAOYSA-N 1 1 341.333 4.067 20 5 EIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000603857570 1037049494 /nfs/dbraw/zinc/04/94/94/1037049494.db2.gz XXRZVHZNLGEPBF-MRXNPFEDSA-N 1 1 346.814 4.464 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3cc4ccccc4[nH]3)C2)cc1 ZINC000603889991 1037078445 /nfs/dbraw/zinc/07/84/45/1037078445.db2.gz JFYHKSFNZSAINO-KRWDZBQOSA-N 1 1 335.407 4.456 20 5 EIBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@@H]2c2ccsc2)cc1 ZINC000604012184 1037147169 /nfs/dbraw/zinc/14/71/69/1037147169.db2.gz IOEHJSOPKSMHDZ-QGZVFWFLSA-N 1 1 332.425 4.262 20 5 EIBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+](Cc2cccs2)C2CC2)cc1 ZINC000604012318 1037148238 /nfs/dbraw/zinc/14/82/38/1037148238.db2.gz WPILCXADNUCWOE-UHFFFAOYSA-N 1 1 332.425 4.090 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@H]2CCC3(CCCC3)O2)C2CC2)cc1 ZINC000570025190 1037377676 /nfs/dbraw/zinc/37/76/76/1037377676.db2.gz XBDMBPDMQAVHQO-GOSISDBHSA-N 1 1 330.428 4.051 20 5 EIBDMO CC(C)c1cc(C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)on1 ZINC000591348026 1037391290 /nfs/dbraw/zinc/39/12/90/1037391290.db2.gz WGWWYLXFIXLFKD-QGZVFWFLSA-N 1 1 329.400 4.264 20 5 EIBDMO CCC[N@@H+](Cc1ccc(OC)cc1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000604492940 1037407381 /nfs/dbraw/zinc/40/73/81/1037407381.db2.gz CHAGJUQKEOQKTO-UHFFFAOYSA-N 1 1 344.411 4.024 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@]1(c2ccc(Cl)cc2)C[C@@H]1C ZINC000503373658 1037716619 /nfs/dbraw/zinc/71/66/19/1037716619.db2.gz XWNPZEUHXDQNSL-KPZWWZAWSA-N 1 1 346.814 4.282 20 5 EIBDMO COc1ccc(C[NH2+]C2(c3ccccc3Cl)CC2)cc1[N+](=O)[O-] ZINC000592137236 1037751396 /nfs/dbraw/zinc/75/13/96/1037751396.db2.gz HNTGPPZPHXMPMD-UHFFFAOYSA-N 1 1 332.787 4.036 20 5 EIBDMO CC(C)O[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000593054672 1037912772 /nfs/dbraw/zinc/91/27/72/1037912772.db2.gz YVNNRRSIIJJKTP-CQSZACIVSA-N 1 1 346.349 4.003 20 5 EIBDMO CC(C)O[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000593054672 1037912802 /nfs/dbraw/zinc/91/28/02/1037912802.db2.gz YVNNRRSIIJJKTP-CQSZACIVSA-N 1 1 346.349 4.003 20 5 EIBDMO CC(C)c1ccc([C@H](N)C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000423243136 1038075738 /nfs/dbraw/zinc/07/57/38/1038075738.db2.gz MTRKAWPNUDPSRU-IFXJQAMLSA-N 1 1 327.428 4.069 20 5 EIBDMO COC[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000490060566 1038326325 /nfs/dbraw/zinc/32/63/25/1038326325.db2.gz NKRSJUQKESVANC-QGZVFWFLSA-N 1 1 334.803 4.068 20 5 EIBDMO COC[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000490060565 1038327124 /nfs/dbraw/zinc/32/71/24/1038327124.db2.gz NKRSJUQKESVANC-KRWDZBQOSA-N 1 1 334.803 4.068 20 5 EIBDMO CC[C@@H](C)[N@H+](C)CCNCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000608910904 1038950341 /nfs/dbraw/zinc/95/03/41/1038950341.db2.gz VWONUVPDECSGGW-CQSZACIVSA-N 1 1 347.484 4.143 20 5 EIBDMO CC[C@@H](C)[N@@H+](C)CCNCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000608910904 1038950372 /nfs/dbraw/zinc/95/03/72/1038950372.db2.gz VWONUVPDECSGGW-CQSZACIVSA-N 1 1 347.484 4.143 20 5 EIBDMO CC[C@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000534122740 1039121734 /nfs/dbraw/zinc/12/17/34/1039121734.db2.gz WOQAKDMVJRMQGB-AWEZNQCLSA-N 1 1 329.400 4.262 20 5 EIBDMO CCC1CCC([N@@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000514087854 1039590452 /nfs/dbraw/zinc/59/04/52/1039590452.db2.gz IOKFPFIVUMRVHG-UHFFFAOYSA-N 1 1 344.415 4.045 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000481691669 1039733736 /nfs/dbraw/zinc/73/37/36/1039733736.db2.gz HZAUUISFFIEQRE-FOIQADDNSA-N 1 1 338.407 4.177 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+]C(c1ccccc1)c1ccccc1 ZINC000429790650 1039736622 /nfs/dbraw/zinc/73/66/22/1039736622.db2.gz NOAMHXXMOGDESG-UHFFFAOYSA-N 1 1 348.402 4.483 20 5 EIBDMO CC(C)[C@H]1CCCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000534857159 1039826857 /nfs/dbraw/zinc/82/68/57/1039826857.db2.gz JPKSKYINVDVVRG-QGZVFWFLSA-N 1 1 329.400 4.260 20 5 EIBDMO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2ccc(OC)c([N+](=O)[O-])c2)s1 ZINC000122137612 1039863351 /nfs/dbraw/zinc/86/33/51/1039863351.db2.gz PHUNFUXRDNZVJS-LBPRGKRZSA-N 1 1 349.456 4.124 20 5 EIBDMO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccc(OC)c([N+](=O)[O-])c2)s1 ZINC000122137612 1039863353 /nfs/dbraw/zinc/86/33/53/1039863353.db2.gz PHUNFUXRDNZVJS-LBPRGKRZSA-N 1 1 349.456 4.124 20 5 EIBDMO C[C@@H](CCN(C)C)[NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000481951760 1039908913 /nfs/dbraw/zinc/90/89/13/1039908913.db2.gz HFZMTAVWVDUGJS-KBPBESRZSA-N 1 1 347.484 4.314 20 5 EIBDMO C[C@@H](CC[NH+](C)C)N[C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000481951760 1039908931 /nfs/dbraw/zinc/90/89/31/1039908931.db2.gz HFZMTAVWVDUGJS-KBPBESRZSA-N 1 1 347.484 4.314 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H](c3nc4ccccc4o3)C2)c1 ZINC000029824794 1040282285 /nfs/dbraw/zinc/28/22/85/1040282285.db2.gz JHNTYJJVLQSOBG-HNNXBMFYSA-N 1 1 337.379 4.116 20 5 EIBDMO Cc1ccc(C[N@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000089883392 1040493616 /nfs/dbraw/zinc/49/36/16/1040493616.db2.gz GCDRIIGMZHIVEM-UHFFFAOYSA-N 1 1 337.379 4.190 20 5 EIBDMO Cc1ccc(C[N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000089883392 1040493626 /nfs/dbraw/zinc/49/36/26/1040493626.db2.gz GCDRIIGMZHIVEM-UHFFFAOYSA-N 1 1 337.379 4.190 20 5 EIBDMO C[C@@H](c1ccccc1)[N@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089883090 1040503725 /nfs/dbraw/zinc/50/37/25/1040503725.db2.gz VUQWQKIEFFBDKX-AWEZNQCLSA-N 1 1 337.379 4.443 20 5 EIBDMO C[C@@H](c1ccccc1)[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089883090 1040503744 /nfs/dbraw/zinc/50/37/44/1040503744.db2.gz VUQWQKIEFFBDKX-AWEZNQCLSA-N 1 1 337.379 4.443 20 5 EIBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCC(C)(C)C1 ZINC000483106997 1040702640 /nfs/dbraw/zinc/70/26/40/1040702640.db2.gz CHPKFQIFKUEBIJ-MRXNPFEDSA-N 1 1 343.427 4.303 20 5 EIBDMO C[C@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1C ZINC000539825907 1040822459 /nfs/dbraw/zinc/82/24/59/1040822459.db2.gz XRMPGKKHASICCW-QWHCGFSZSA-N 1 1 331.441 4.196 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCOCC23CCC3)s1 ZINC000539827698 1040822943 /nfs/dbraw/zinc/82/29/43/1040822943.db2.gz SLPOZOKJELWSJF-UHFFFAOYSA-N 1 1 344.436 4.078 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCOCC23CCC3)s1 ZINC000539827698 1040822944 /nfs/dbraw/zinc/82/29/44/1040822944.db2.gz SLPOZOKJELWSJF-UHFFFAOYSA-N 1 1 344.436 4.078 20 5 EIBDMO Cc1ccc(C[N@H+]2CCC[C@H]2CC(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000539837348 1040833925 /nfs/dbraw/zinc/83/39/25/1040833925.db2.gz UEPZZLZZFVLXFT-SFHVURJKSA-N 1 1 338.407 4.141 20 5 EIBDMO COc1cccc(C[C@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000515553203 1040850729 /nfs/dbraw/zinc/85/07/29/1040850729.db2.gz XAHFNLZOWQCVSM-GOSISDBHSA-N 1 1 340.423 4.119 20 5 EIBDMO CC[N@@H+](Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])CC(C)(C)C ZINC000462832791 1041014045 /nfs/dbraw/zinc/01/40/45/1041014045.db2.gz IRNMBRFODFPRCN-UHFFFAOYSA-N 1 1 346.374 4.073 20 5 EIBDMO COc1cc(C[N@@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)ccc1[N+](=O)[O-] ZINC000484344653 1041217701 /nfs/dbraw/zinc/21/77/01/1041217701.db2.gz OLIUEPNRQZLTTD-AWEZNQCLSA-N 1 1 346.349 4.014 20 5 EIBDMO COc1cc(C[N@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)ccc1[N+](=O)[O-] ZINC000484344653 1041217724 /nfs/dbraw/zinc/21/77/24/1041217724.db2.gz OLIUEPNRQZLTTD-AWEZNQCLSA-N 1 1 346.349 4.014 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](COc2ccccc2)C1 ZINC000505880238 1041476316 /nfs/dbraw/zinc/47/63/16/1041476316.db2.gz RLNRIGYVHQZZCO-HOTGVXAUSA-N 1 1 326.396 4.057 20 5 EIBDMO CC(C)[C@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000538812950 1041550049 /nfs/dbraw/zinc/55/00/49/1041550049.db2.gz RCIGGWXHHZJUTO-AWEZNQCLSA-N 1 1 331.441 4.196 20 5 EIBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463445156 1041570213 /nfs/dbraw/zinc/57/02/13/1041570213.db2.gz TVXHFTMLMQIRDH-CABCVRRESA-N 1 1 346.349 4.027 20 5 EIBDMO C[C@@H]1c2ccccc2C[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000541201050 1041842808 /nfs/dbraw/zinc/84/28/08/1041842808.db2.gz JDFNRSQHIHQECM-CQSZACIVSA-N 1 1 349.390 4.369 20 5 EIBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H]1CC=CCC1 ZINC000541315500 1041889305 /nfs/dbraw/zinc/88/93/05/1041889305.db2.gz CKUROJLUXSSQOS-OAHLLOKOSA-N 1 1 341.411 4.080 20 5 EIBDMO COc1cccc(F)c1[C@@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000122438663 1041956158 /nfs/dbraw/zinc/95/61/58/1041956158.db2.gz TVVWSUGZMGQGKD-CHWSQXEVSA-N 1 1 332.375 4.463 20 5 EIBDMO COc1cccc(F)c1[C@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000122438403 1041962070 /nfs/dbraw/zinc/96/20/70/1041962070.db2.gz TVVWSUGZMGQGKD-STQMWFEESA-N 1 1 332.375 4.463 20 5 EIBDMO CCC[C@H]1[C@@H](C)CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000464731336 1042135963 /nfs/dbraw/zinc/13/59/63/1042135963.db2.gz FDWZAXAMDAQFBP-BBRMVZONSA-N 1 1 344.415 4.045 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H](C)C[C@H]1c1ccccc1F ZINC000464725059 1042140422 /nfs/dbraw/zinc/14/04/22/1042140422.db2.gz LNVLPKBCIQYGEP-UGSOOPFHSA-N 1 1 344.386 4.326 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](C)C[C@H]1c1ccccc1F ZINC000464725059 1042140424 /nfs/dbraw/zinc/14/04/24/1042140424.db2.gz LNVLPKBCIQYGEP-UGSOOPFHSA-N 1 1 344.386 4.326 20 5 EIBDMO C[C@H]1C[C@H](c2ccccc2F)[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000464729082 1042142420 /nfs/dbraw/zinc/14/24/20/1042142420.db2.gz ZGUSGFVDSNJEPY-IFXJQAMLSA-N 1 1 328.387 4.360 20 5 EIBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@H](CSc3ccccc3)C2)cc1 ZINC000464776691 1042158642 /nfs/dbraw/zinc/15/86/42/1042158642.db2.gz SGWBXOYSZQJFLL-KRWDZBQOSA-N 1 1 342.464 4.252 20 5 EIBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+](C)C2CCC2)cc1OC ZINC000541985976 1042209127 /nfs/dbraw/zinc/20/91/27/1042209127.db2.gz ZHISPBADUTXKLJ-ZDUSSCGKSA-N 1 1 336.432 4.013 20 5 EIBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc(C2CC2)cc1F ZINC000491550950 1042469278 /nfs/dbraw/zinc/46/92/78/1042469278.db2.gz ZJZWRZCLJKLMQI-UHFFFAOYSA-N 1 1 344.386 4.300 20 5 EIBDMO COc1ccc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c(Cl)c1 ZINC000492224603 1042585196 /nfs/dbraw/zinc/58/51/96/1042585196.db2.gz JPACRUCKZNJMFX-UHFFFAOYSA-N 1 1 334.803 4.282 20 5 EIBDMO CCOc1cc(C[N@H+]([C@@H](C)c2ccco2)C2CC2)ccc1[N+](=O)[O-] ZINC000492540402 1042692703 /nfs/dbraw/zinc/69/27/03/1042692703.db2.gz UQDSUTDJCUIUPO-ZDUSSCGKSA-N 1 1 330.384 4.312 20 5 EIBDMO CCOc1cc(C[N@@H+]([C@@H](C)c2ccco2)C2CC2)ccc1[N+](=O)[O-] ZINC000492540402 1042692707 /nfs/dbraw/zinc/69/27/07/1042692707.db2.gz UQDSUTDJCUIUPO-ZDUSSCGKSA-N 1 1 330.384 4.312 20 5 EIBDMO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000282483251 1043232241 /nfs/dbraw/zinc/23/22/41/1043232241.db2.gz PBWSFIAAUUOYSD-CYBMUJFWSA-N 1 1 331.416 4.116 20 5 EIBDMO C[C@H](c1ncc(C(C)(C)C)o1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000282483251 1043232250 /nfs/dbraw/zinc/23/22/50/1043232250.db2.gz PBWSFIAAUUOYSD-CYBMUJFWSA-N 1 1 331.416 4.116 20 5 EIBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)Nc2cccc(F)c2[N+](=O)[O-])cc1 ZINC000301757417 1043327534 /nfs/dbraw/zinc/32/75/34/1043327534.db2.gz YRCSLZGCYDOCOY-GFCCVEGCSA-N 1 1 340.358 4.401 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](Cc1ccc(F)cc1)C(C)C ZINC000521220857 1043656239 /nfs/dbraw/zinc/65/62/39/1043656239.db2.gz QICHEGIVJKUSAK-UHFFFAOYSA-N 1 1 332.375 4.153 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](Cc1ccc(F)cc1)C(C)C ZINC000521220857 1043656242 /nfs/dbraw/zinc/65/62/42/1043656242.db2.gz QICHEGIVJKUSAK-UHFFFAOYSA-N 1 1 332.375 4.153 20 5 EIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC=C(c2ccc(O)cc2)CC1 ZINC000255850022 1043807422 /nfs/dbraw/zinc/80/74/22/1043807422.db2.gz SVTWHGGPZQBVGJ-HYXAFXHYSA-N 1 1 336.391 4.103 20 5 EIBDMO CC[N@@H+](Cc1c[nH]c2ccccc12)Cc1cc([N+](=O)[O-])ccc1OC ZINC000442893087 1043886354 /nfs/dbraw/zinc/88/63/54/1043886354.db2.gz RLFRXUHUMHORPP-UHFFFAOYSA-N 1 1 339.395 4.107 20 5 EIBDMO C[C@@H]([NH2+][C@H](CN1CCCC1)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000173304472 1043888743 /nfs/dbraw/zinc/88/87/43/1043888743.db2.gz QJSUSTJRRAKPFE-OXQOHEQNSA-N 1 1 339.439 4.083 20 5 EIBDMO C[C@H]1C[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@H]1c1ccccc1 ZINC000245895315 1044206290 /nfs/dbraw/zinc/20/62/90/1044206290.db2.gz PDRIEQVUHULFMD-IFXJQAMLSA-N 1 1 349.390 4.443 20 5 EIBDMO C[C@H]1C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)[C@H]1c1ccccc1 ZINC000245895315 1044206305 /nfs/dbraw/zinc/20/63/05/1044206305.db2.gz PDRIEQVUHULFMD-IFXJQAMLSA-N 1 1 349.390 4.443 20 5 EIBDMO CCC[C@H]1CCC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000246564526 1044332973 /nfs/dbraw/zinc/33/29/73/1044332973.db2.gz NLPBRWYHTWKFTP-KGLIPLIRSA-N 1 1 344.415 4.218 20 5 EIBDMO CCCCOc1ncccc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000154751003 1044833471 /nfs/dbraw/zinc/83/34/71/1044833471.db2.gz CMGRTLNOZUGHNK-HNNXBMFYSA-N 1 1 343.427 4.328 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CCCc4cccnc43)o2)cc1 ZINC000922882319 1045023378 /nfs/dbraw/zinc/02/33/78/1045023378.db2.gz NIJGUGBUSXMORM-GOSISDBHSA-N 1 1 349.390 4.417 20 5 EIBDMO COCC[C@@H]1CCCC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000470208339 1045064315 /nfs/dbraw/zinc/06/43/15/1045064315.db2.gz RLOCHBVYXWLCMQ-MOKGIYGOSA-N 1 1 332.444 4.137 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@@H]2CCOc3ccccc32)C2CC2)cc1 ZINC000611254764 1045265994 /nfs/dbraw/zinc/26/59/94/1045265994.db2.gz QVKLFDNQJDFBAZ-INIZCTEOSA-N 1 1 338.407 4.126 20 5 EIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000611268264 1045271517 /nfs/dbraw/zinc/27/15/17/1045271517.db2.gz DXBPAWNVBIKVBN-QLQLNADESA-N 1 1 338.407 4.072 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+][C@H]2COc3c2cccc3Cl)cc1[N+](=O)[O-] ZINC000611336164 1045280862 /nfs/dbraw/zinc/28/08/62/1045280862.db2.gz XHZFVDYQQVMOJU-NHYWBVRUSA-N 1 1 332.787 4.341 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000611515615 1045320739 /nfs/dbraw/zinc/32/07/39/1045320739.db2.gz HCRBTJQTRCRNFZ-OXQOHEQNSA-N 1 1 340.423 4.428 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000611517049 1045321274 /nfs/dbraw/zinc/32/12/74/1045321274.db2.gz KYRSCGUKCBMUPN-ULQDDVLXSA-N 1 1 332.444 4.103 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)ccc1Cl ZINC000768549105 1045822988 /nfs/dbraw/zinc/82/29/88/1045822988.db2.gz OPIPHDRERLYUHD-UKRRQHHQSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCS[C@@H]3CCCC[C@H]32)ccc1Cl ZINC000768549105 1045822986 /nfs/dbraw/zinc/82/29/86/1045822986.db2.gz OPIPHDRERLYUHD-UKRRQHHQSA-N 1 1 326.849 4.108 20 5 EIBDMO CCOc1ccc([C@H](C)[NH2+][C@H](C)c2c(C)noc2C)cc1[N+](=O)[O-] ZINC000153789986 1045843274 /nfs/dbraw/zinc/84/32/74/1045843274.db2.gz NBBJSWVQZNDHSP-WDEREUQCSA-N 1 1 333.388 4.010 20 5 EIBDMO CCC(=O)N1CCC[N@@H+](Cc2c3ccccc3cc3ccccc32)CC1 ZINC000768926729 1045861509 /nfs/dbraw/zinc/86/15/09/1045861509.db2.gz PPWDGRZJDPOTNG-UHFFFAOYSA-N 1 1 346.474 4.437 20 5 EIBDMO Cn1c2ccccc2cc1[N@@H+]1c2ccccc2C=C2C(=O)C(N)=CC=C21 ZINC001212052629 1045876995 /nfs/dbraw/zinc/87/69/95/1045876995.db2.gz YMWQLMYDCPIPLN-UHFFFAOYSA-N 1 1 339.398 4.169 20 5 EIBDMO Cn1c2ccccc2cc1[N@H+]1c2ccccc2C=C2C(=O)C(N)=CC=C21 ZINC001212052629 1045877009 /nfs/dbraw/zinc/87/70/09/1045877009.db2.gz YMWQLMYDCPIPLN-UHFFFAOYSA-N 1 1 339.398 4.169 20 5 EIBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](CC(C)C)[C@H](C)c1ccccc1C ZINC001170244612 1045949153 /nfs/dbraw/zinc/94/91/53/1045949153.db2.gz NQTMHKZRJDQXLR-MRXNPFEDSA-N 1 1 344.459 4.127 20 5 EIBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC001170347166 1046021271 /nfs/dbraw/zinc/02/12/71/1046021271.db2.gz QYRVBLAPXDIHTG-CJNGLKHVSA-N 1 1 346.452 4.433 20 5 EIBDMO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000536662335 1046633866 /nfs/dbraw/zinc/63/38/66/1046633866.db2.gz YDNMYKKWWVGLQS-CYBMUJFWSA-N 1 1 333.457 4.424 20 5 EIBDMO CC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cc(Cl)ccc1OC ZINC000536875315 1046839126 /nfs/dbraw/zinc/83/91/26/1046839126.db2.gz GRCKBFAWXSWEEA-OAHLLOKOSA-N 1 1 334.803 4.498 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000787405582 1047007107 /nfs/dbraw/zinc/00/71/07/1047007107.db2.gz AFAHGEKKGMCPBY-GXDHUFHOSA-N 1 1 341.367 4.038 20 5 EIBDMO C[C@H]1SCC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H]1c1ccccc1 ZINC000788479876 1047197537 /nfs/dbraw/zinc/19/75/37/1047197537.db2.gz FLDVBHIPWLWRHT-ACJLOTCBSA-N 1 1 346.427 4.413 20 5 EIBDMO C[C@H]1SCC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H]1c1ccccc1 ZINC000788479876 1047197526 /nfs/dbraw/zinc/19/75/26/1047197526.db2.gz FLDVBHIPWLWRHT-ACJLOTCBSA-N 1 1 346.427 4.413 20 5 EIBDMO C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788481037 1047198500 /nfs/dbraw/zinc/19/85/00/1047198500.db2.gz OZRFBGAUOQMYPC-DOMZBBRYSA-N 1 1 332.350 4.251 20 5 EIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCC[C@@H](c2nccs2)C1 ZINC000163518699 1047581908 /nfs/dbraw/zinc/58/19/08/1047581908.db2.gz KQPOFVCOUNEPTN-LLVKDONJSA-N 1 1 337.832 4.084 20 5 EIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@@H](c2nccs2)C1 ZINC000163518699 1047581920 /nfs/dbraw/zinc/58/19/20/1047581920.db2.gz KQPOFVCOUNEPTN-LLVKDONJSA-N 1 1 337.832 4.084 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@H]3CF)o2)c(Cl)c1 ZINC000556949909 1048312141 /nfs/dbraw/zinc/31/21/41/1048312141.db2.gz GTPJJPZHPAIARO-LBPRGKRZSA-N 1 1 338.766 4.442 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@H]3CF)o2)c(Cl)c1 ZINC000556949909 1048312149 /nfs/dbraw/zinc/31/21/49/1048312149.db2.gz GTPJJPZHPAIARO-LBPRGKRZSA-N 1 1 338.766 4.442 20 5 EIBDMO CC[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])[C@@H]1CCOC(C)(C)C1 ZINC000810043205 1048607270 /nfs/dbraw/zinc/60/72/70/1048607270.db2.gz HUICQTQBHPKYKK-CQSZACIVSA-N 1 1 326.824 4.028 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@]3(CC3(F)F)C2)o1 ZINC000846108854 1048814497 /nfs/dbraw/zinc/81/44/97/1048814497.db2.gz RYFBXHQZBLOMEE-QGZVFWFLSA-N 1 1 348.349 4.476 20 5 EIBDMO CC(C)[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H](C)c1ccsc1 ZINC000817287208 1048925635 /nfs/dbraw/zinc/92/56/35/1048925635.db2.gz LFQJWKXIADKCJD-GUYCJALGSA-N 1 1 334.441 4.161 20 5 EIBDMO CC(C)[N@@H+](CCOc1ccc(F)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350416 1049053201 /nfs/dbraw/zinc/05/32/01/1049053201.db2.gz BOCXIECWMWUUIW-UHFFFAOYSA-N 1 1 332.375 4.023 20 5 EIBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000609432103 1049062744 /nfs/dbraw/zinc/06/27/44/1049062744.db2.gz CJUHQCUFDFGFLF-HNNXBMFYSA-N 1 1 328.412 4.057 20 5 EIBDMO COc1cccc(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])c1 ZINC000811471959 1049093475 /nfs/dbraw/zinc/09/34/75/1049093475.db2.gz OSGIAUGRVQOYAB-UHFFFAOYSA-N 1 1 341.194 4.200 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@H]1CCOC(C)(C)C1 ZINC000811511172 1049124582 /nfs/dbraw/zinc/12/45/82/1049124582.db2.gz DTFUIHZDUDHIAX-ZDUSSCGKSA-N 1 1 326.824 4.028 20 5 EIBDMO Cc1c(C[N@@H+](CCc2ccc(F)cc2)C2CC2)cccc1[N+](=O)[O-] ZINC000609744368 1049297506 /nfs/dbraw/zinc/29/75/06/1049297506.db2.gz FTZUUEYNCSHOBG-UHFFFAOYSA-N 1 1 328.387 4.249 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000609800735 1049327215 /nfs/dbraw/zinc/32/72/15/1049327215.db2.gz RFBZKFAYRVANDB-RDTXWAMCSA-N 1 1 328.437 4.446 20 5 EIBDMO C[C@H]1SCC[N@H+](Cc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000609829404 1049349623 /nfs/dbraw/zinc/34/96/23/1049349623.db2.gz AJNGFQRIJVFFNB-RDTXWAMCSA-N 1 1 328.437 4.273 20 5 EIBDMO C[C@H]1SCC[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000609829404 1049349641 /nfs/dbraw/zinc/34/96/41/1049349641.db2.gz AJNGFQRIJVFFNB-RDTXWAMCSA-N 1 1 328.437 4.273 20 5 EIBDMO C[N@@H+](CCc1cccc(Br)c1)Cc1cccc([N+](=O)[O-])c1 ZINC001170662233 1049366806 /nfs/dbraw/zinc/36/68/06/1049366806.db2.gz XQIFQYQJAHDXKQ-UHFFFAOYSA-N 1 1 349.228 4.032 20 5 EIBDMO Cc1ccccc1[C@@H]1C[C@@H](C)[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000610001878 1049466795 /nfs/dbraw/zinc/46/67/95/1049466795.db2.gz JKFCKLTXDCFMEE-HUUCEWRRSA-N 1 1 328.387 4.420 20 5 EIBDMO Cc1cn2cc(Nc3ccc(C(F)(F)F)cc3[N+](=O)[O-])ccc2[nH+]1 ZINC000610116178 1049537972 /nfs/dbraw/zinc/53/79/72/1049537972.db2.gz JZWLXCDZYSPMLB-UHFFFAOYSA-N 1 1 336.273 4.313 20 5 EIBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812850818 1049611556 /nfs/dbraw/zinc/61/15/56/1049611556.db2.gz VTCZMWPHNPFREY-FZKQIMNGSA-N 1 1 348.830 4.192 20 5 EIBDMO C[C@@]1(Cc2cccc(F)c2)CCC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC001171425551 1049664863 /nfs/dbraw/zinc/66/48/63/1049664863.db2.gz FCGCDCVMDDDOGS-IBGZPJMESA-N 1 1 346.377 4.470 20 5 EIBDMO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1cc(F)ccc1[N+](=O)[O-] ZINC000179738453 1049742317 /nfs/dbraw/zinc/74/23/17/1049742317.db2.gz JTNRPMIVZQHLRB-MRXNPFEDSA-N 1 1 332.375 4.374 20 5 EIBDMO C[NH+](C)[C@H](CNc1ccc(F)cc1[N+](=O)[O-])c1ccccc1Cl ZINC000068836937 1049920881 /nfs/dbraw/zinc/92/08/81/1049920881.db2.gz GJWQGRBTPKDCMD-MRXNPFEDSA-N 1 1 337.782 4.102 20 5 EIBDMO CC[N@@H+](Cc1cccs1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172922173 1050236607 /nfs/dbraw/zinc/23/66/07/1050236607.db2.gz WSCRKBITNFWQOP-INIZCTEOSA-N 1 1 330.453 4.426 20 5 EIBDMO C[N@@H+](Cc1ccc(F)cc1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172910385 1050246521 /nfs/dbraw/zinc/24/65/21/1050246521.db2.gz YNPAEADJMSQPFO-SFHVURJKSA-N 1 1 328.387 4.113 20 5 EIBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CC[C@H]2c2ccccc2)c1F ZINC001173196514 1050340972 /nfs/dbraw/zinc/34/09/72/1050340972.db2.gz NEFRFKAKRQPRGC-CJNGLKHVSA-N 1 1 344.386 4.121 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC001173231774 1050359410 /nfs/dbraw/zinc/35/94/10/1050359410.db2.gz CZQSFLRGAXKIFT-RHSMWYFYSA-N 1 1 328.387 4.154 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCSc2ccccc2C1 ZINC001173230810 1050360298 /nfs/dbraw/zinc/36/02/98/1050360298.db2.gz GROYWKKNEURFRC-AWEZNQCLSA-N 1 1 328.437 4.134 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC001173231747 1050360775 /nfs/dbraw/zinc/36/07/75/1050360775.db2.gz CWUNUTPISLMGRX-RHSMWYFYSA-N 1 1 328.387 4.154 20 5 EIBDMO COc1cccc([C@H]2CCC[N@H+]2[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173234799 1050362425 /nfs/dbraw/zinc/36/24/25/1050362425.db2.gz UEQFQWHXKYFOEF-MGPUTAFESA-N 1 1 340.423 4.372 20 5 EIBDMO CCC[N@@H+](CCc1cccs1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000775069276 1050461187 /nfs/dbraw/zinc/46/11/87/1050461187.db2.gz OQYNPEIMXMGYBM-UHFFFAOYSA-N 1 1 349.412 4.019 20 5 EIBDMO CS[C@H]1CC[C@H]([N@@H+](C)Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001180071810 1050873440 /nfs/dbraw/zinc/87/34/40/1050873440.db2.gz IBFDUNNFCUQSNL-STQMWFEESA-N 1 1 348.390 4.330 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(C)c1 ZINC001180178380 1050895406 /nfs/dbraw/zinc/89/54/06/1050895406.db2.gz WIGJMQKYTYFDIA-UHFFFAOYSA-N 1 1 328.412 4.322 20 5 EIBDMO CC(C)C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C ZINC000170908984 1050937755 /nfs/dbraw/zinc/93/77/55/1050937755.db2.gz DQEHXUMCAORSEH-UHFFFAOYSA-N 1 1 331.416 4.159 20 5 EIBDMO CCSc1cccc(C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC001180267125 1050942178 /nfs/dbraw/zinc/94/21/78/1050942178.db2.gz OUBKXZVGDIYSTE-UHFFFAOYSA-N 1 1 328.437 4.265 20 5 EIBDMO CCSc1cccc(C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC001180267125 1050942188 /nfs/dbraw/zinc/94/21/88/1050942188.db2.gz OUBKXZVGDIYSTE-UHFFFAOYSA-N 1 1 328.437 4.265 20 5 EIBDMO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ccc([N+](=O)[O-])cc1C)CCC2 ZINC000183343943 1051096427 /nfs/dbraw/zinc/09/64/27/1051096427.db2.gz FAVBUJIQDVZNGR-INIZCTEOSA-N 1 1 331.441 4.178 20 5 EIBDMO Cc1ccccc1[C@H](C)[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC001175035359 1051328269 /nfs/dbraw/zinc/32/82/69/1051328269.db2.gz GHZGQGLKJLUFNE-INIZCTEOSA-N 1 1 328.412 4.365 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](c2ccccc2C)C[C@@H]1C ZINC001191156997 1051366065 /nfs/dbraw/zinc/36/60/65/1051366065.db2.gz PQSFKFDYWGRJAV-HOTGVXAUSA-N 1 1 340.423 4.290 20 5 EIBDMO Cc1ccc(C[N@@H+](CCOc2ccccc2[N+](=O)[O-])C2CC2)cc1C ZINC001191164800 1051371821 /nfs/dbraw/zinc/37/18/21/1051371821.db2.gz MBANYQYJKDBEBZ-UHFFFAOYSA-N 1 1 340.423 4.255 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCc3cc(C(F)(F)F)ccc3C2)c1 ZINC001175127634 1051397407 /nfs/dbraw/zinc/39/74/07/1051397407.db2.gz FYSMUIXVYXWVHF-UHFFFAOYSA-N 1 1 336.313 4.172 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCc3cc(C(F)(F)F)ccc3C2)c1 ZINC001175127634 1051397414 /nfs/dbraw/zinc/39/74/14/1051397414.db2.gz FYSMUIXVYXWVHF-UHFFFAOYSA-N 1 1 336.313 4.172 20 5 EIBDMO Cc1cc(N2CCC(C[N@H+](C)C(C)C)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000774517517 1051643634 /nfs/dbraw/zinc/64/36/34/1051643634.db2.gz GYVDCKQTZZUBJW-UHFFFAOYSA-N 1 1 339.867 4.113 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCc2c1cccc2F ZINC001176219558 1051963039 /nfs/dbraw/zinc/96/30/39/1051963039.db2.gz ZPCDJUSYIYIVHD-SFHVURJKSA-N 1 1 344.386 4.298 20 5 EIBDMO C[C@@H]1C[C@H](C)CC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC001176252134 1051984000 /nfs/dbraw/zinc/98/40/00/1051984000.db2.gz CEZBWMUSBRHLHU-VXGBXAGGSA-N 1 1 341.249 4.225 20 5 EIBDMO Cc1ccc([C@H]2CC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)c(C)c1 ZINC001194074096 1052070250 /nfs/dbraw/zinc/07/02/50/1052070250.db2.gz PUEHIRSEPFXVRU-KRWDZBQOSA-N 1 1 340.423 4.080 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](C[C@H]3C[C@@H]4[C@H](C3)C4(F)F)C2)cc1 ZINC001194478692 1052158837 /nfs/dbraw/zinc/15/88/37/1052158837.db2.gz WTNVXUKVCLQXCT-QIJZBDPFSA-N 1 1 336.382 4.066 20 5 EIBDMO C[C@H]1CCCC[N@H+]1CCC1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001185701605 1052284766 /nfs/dbraw/zinc/28/47/66/1052284766.db2.gz LDLNOWDMHJNPGM-INIZCTEOSA-N 1 1 331.460 4.076 20 5 EIBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000794685298 1053262618 /nfs/dbraw/zinc/26/26/18/1053262618.db2.gz ORGTVIQCPCSIRN-AWEZNQCLSA-N 1 1 343.383 4.475 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCSC3(CCC3)CC2)c1 ZINC001195138156 1053288492 /nfs/dbraw/zinc/28/84/92/1053288492.db2.gz WDLUPXYMDKCASX-UHFFFAOYSA-N 1 1 326.849 4.110 20 5 EIBDMO CC1(C)C[C@@H](c2ccccc2)[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC001195376237 1053392044 /nfs/dbraw/zinc/39/20/44/1053392044.db2.gz HPBLWFZORYCZAJ-SFHVURJKSA-N 1 1 340.423 4.447 20 5 EIBDMO Cc1ccc(C)c([C@@H]2CCC[N@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000776585869 1053568526 /nfs/dbraw/zinc/56/85/26/1053568526.db2.gz BMMIOFRYYJYMTG-PMACEKPBSA-N 1 1 340.423 4.082 20 5 EIBDMO COc1cc(C[N@H+]2CCCC[C@@H]2CC2CCC2)c([N+](=O)[O-])cc1F ZINC001196328887 1053640170 /nfs/dbraw/zinc/64/01/70/1053640170.db2.gz JITDNXNTTYVIOT-OAHLLOKOSA-N 1 1 336.407 4.287 20 5 EIBDMO COC[C@@H](C)[N@H+](Cc1csc([N+](=O)[O-])c1)[C@H]1CCc2ccccc21 ZINC001196646027 1053711508 /nfs/dbraw/zinc/71/15/08/1053711508.db2.gz FKNNJLXVDOKOEM-DYVFJYSZSA-N 1 1 346.452 4.181 20 5 EIBDMO COC[C@@H](C)[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@H]1CCc2ccccc21 ZINC001196646027 1053711521 /nfs/dbraw/zinc/71/15/21/1053711521.db2.gz FKNNJLXVDOKOEM-DYVFJYSZSA-N 1 1 346.452 4.181 20 5 EIBDMO CC(C)(O)C[N@@H+](Cc1ccccc1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000775765766 1053869224 /nfs/dbraw/zinc/86/92/24/1053869224.db2.gz RDAIAHVFLYXNIA-UHFFFAOYSA-N 1 1 348.830 4.021 20 5 EIBDMO COc1ccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cc1C ZINC001197621930 1053946403 /nfs/dbraw/zinc/94/64/03/1053946403.db2.gz LMZLQIFTANBSNN-LBPRGKRZSA-N 1 1 334.803 4.416 20 5 EIBDMO Cc1csc(C[C@@H]2CC[N@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC001198084062 1054067793 /nfs/dbraw/zinc/06/77/93/1054067793.db2.gz FRFUFICSFDMOJA-CABCVRRESA-N 1 1 345.468 4.294 20 5 EIBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(C(F)(F)F)nc1 ZINC000871937663 1054324126 /nfs/dbraw/zinc/32/41/26/1054324126.db2.gz XCKDIGZWTMXJTD-QWRGUYRKSA-N 1 1 339.317 4.420 20 5 EIBDMO C[C@@H]([NH2+][C@@H]1CCCOc2ccccc21)c1c(F)cccc1[N+](=O)[O-] ZINC000872031290 1054348107 /nfs/dbraw/zinc/34/81/07/1054348107.db2.gz NWNDPBTXKPYPIZ-IUODEOHRSA-N 1 1 330.359 4.298 20 5 EIBDMO CC(C)c1ccc(CNC[C@@H](C)[N@@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC001199295593 1054381779 /nfs/dbraw/zinc/38/17/79/1054381779.db2.gz KJPQWRJEEUWTRV-JKSUJKDBSA-N 1 1 333.476 4.071 20 5 EIBDMO CC(C)c1ccc(CNC[C@@H](C)[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC001199295593 1054381788 /nfs/dbraw/zinc/38/17/88/1054381788.db2.gz KJPQWRJEEUWTRV-JKSUJKDBSA-N 1 1 333.476 4.071 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](OC3CCC3)CC2)cc1Cl ZINC000872259354 1054427015 /nfs/dbraw/zinc/42/70/15/1054427015.db2.gz UFVHDNFZGCSUIY-HNNXBMFYSA-N 1 1 338.835 4.172 20 5 EIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H](OC2CCC2)CC1 ZINC000872260390 1054427964 /nfs/dbraw/zinc/42/79/64/1054427964.db2.gz OZLMWEJKQVUONL-UKTKYZJWSA-N 1 1 330.428 4.032 20 5 EIBDMO Cc1c(CNCc2ccccc2C[N@@H+](C)C(C)C)cccc1[N+](=O)[O-] ZINC000873012138 1054476668 /nfs/dbraw/zinc/47/66/68/1054476668.db2.gz NTRAGTZZDHVIRH-UHFFFAOYSA-N 1 1 341.455 4.033 20 5 EIBDMO Cc1c(CNCc2ccccc2C[N@H+](C)C(C)C)cccc1[N+](=O)[O-] ZINC000873012138 1054476677 /nfs/dbraw/zinc/47/66/77/1054476677.db2.gz NTRAGTZZDHVIRH-UHFFFAOYSA-N 1 1 341.455 4.033 20 5 EIBDMO Cc1csc([C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)n1 ZINC000877815007 1055127617 /nfs/dbraw/zinc/12/76/17/1055127617.db2.gz ZQGNKTJERFPHND-GFCCVEGCSA-N 1 1 337.832 4.003 20 5 EIBDMO CC(C)[N@H+](Cc1cccc(Cl)c1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776273768 1055139878 /nfs/dbraw/zinc/13/98/78/1055139878.db2.gz AFWDALSJDZILHA-GOSISDBHSA-N 1 1 348.830 4.192 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H]2c2ccccc2Cl)cc1 ZINC000776278263 1055150939 /nfs/dbraw/zinc/15/09/39/1055150939.db2.gz SRINXRXKZPNFEH-ZWKOTPCHSA-N 1 1 346.814 4.119 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCCCC[C@H]2c2ccccc2)cc1 ZINC000776279753 1055154126 /nfs/dbraw/zinc/15/41/26/1055154126.db2.gz YUOPUQMZTAEIDG-PMACEKPBSA-N 1 1 340.423 4.246 20 5 EIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@H](CSc2ccccc2)C1 ZINC000743859982 1059169949 /nfs/dbraw/zinc/16/99/49/1059169949.db2.gz NAULGHJZQVZVJN-AWEZNQCLSA-N 1 1 346.427 4.348 20 5 EIBDMO CC(C)C[N@H+](Cc1ccccc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000746061850 1059988719 /nfs/dbraw/zinc/98/87/19/1059988719.db2.gz LFFHNIVJHSNYJR-UHFFFAOYSA-N 1 1 338.411 4.060 20 5 EIBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@@H+](CCc2ccccc2)Cc2ccccc2)C1 ZINC001169039300 1060596260 /nfs/dbraw/zinc/59/62/60/1060596260.db2.gz PKYPRGWLLIOVFM-LEWJYISDSA-N 1 1 338.451 4.177 20 5 EIBDMO CCC1(CC)C[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CCS1 ZINC001169024070 1060601522 /nfs/dbraw/zinc/60/15/22/1060601522.db2.gz JWPVUDVLICVHDD-UHFFFAOYSA-N 1 1 328.865 4.356 20 5 EIBDMO CCC1(CC)C[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CCS1 ZINC001169024070 1060601555 /nfs/dbraw/zinc/60/15/55/1060601555.db2.gz JWPVUDVLICVHDD-UHFFFAOYSA-N 1 1 328.865 4.356 20 5 EIBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC001169057109 1060613712 /nfs/dbraw/zinc/61/37/12/1060613712.db2.gz UWFKAZCZFNCUJF-APHBMKBZSA-N 1 1 342.361 4.288 20 5 EIBDMO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1OC)c1ccc(F)cc1F ZINC000430208307 1019337010 /nfs/dbraw/zinc/33/70/10/1019337010.db2.gz UKNKZILMUYIWPY-INIZCTEOSA-N 1 1 336.338 4.123 20 5 EIBDMO COc1ccc(C[C@@H]2CCC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000610217350 1019427672 /nfs/dbraw/zinc/42/76/72/1019427672.db2.gz JCGLOISKFCZSEM-KRWDZBQOSA-N 1 1 340.423 4.058 20 5 EIBDMO Cc1c(C[NH2+]Cc2ccc(Cl)cc2Cl)cccc1[N+](=O)[O-] ZINC000225776770 1019731268 /nfs/dbraw/zinc/73/12/68/1019731268.db2.gz WPBTWVZHTOZIAJ-UHFFFAOYSA-N 1 1 325.195 4.500 20 5 EIBDMO CC[C@H](c1ccccc1)N(C)c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1 ZINC001167128342 1020295195 /nfs/dbraw/zinc/29/51/95/1020295195.db2.gz RVFMJRLPNXLCEG-FMQWLBJXSA-N 1 1 340.427 4.110 20 5 EIBDMO C[C@H]1CCCCC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000547931361 1020894774 /nfs/dbraw/zinc/89/47/74/1020894774.db2.gz QJFNDNXWBZQUNE-ZDUSSCGKSA-N 1 1 331.441 4.483 20 5 EIBDMO C[N@H+]1CCC[C@@H](CNc2ccsc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000610281328 1020965286 /nfs/dbraw/zinc/96/52/86/1020965286.db2.gz MWHWVYQXOJYLIN-SMDDNHRTSA-N 1 1 337.470 4.213 20 5 EIBDMO C[N@H+]1CCC[C@H](CNc2ccsc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000610281325 1020965331 /nfs/dbraw/zinc/96/53/31/1020965331.db2.gz MWHWVYQXOJYLIN-BXUZGUMPSA-N 1 1 337.470 4.213 20 5 EIBDMO C[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])s2)[C@H]1c1cccs1 ZINC000610281334 1020966054 /nfs/dbraw/zinc/96/60/54/1020966054.db2.gz QJBGYZQFGUKPKZ-ABAIWWIYSA-N 1 1 337.470 4.213 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1c(F)cc(F)cc1F)CCC2 ZINC000340488719 1021122051 /nfs/dbraw/zinc/12/20/51/1021122051.db2.gz ODUAUKSTLDJLLW-KRWDZBQOSA-N 1 1 336.313 4.179 20 5 EIBDMO COc1ccc(C[N@@H+]2CC[C@H](C)C[C@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000610372205 1021553126 /nfs/dbraw/zinc/55/31/26/1021553126.db2.gz ZVQMNSSRFNXLPV-ZFWWWQNUSA-N 1 1 330.384 4.170 20 5 EIBDMO COc1ccc(C[N@H+]2CC[C@H](C)C[C@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000610372205 1021553146 /nfs/dbraw/zinc/55/31/46/1021553146.db2.gz ZVQMNSSRFNXLPV-ZFWWWQNUSA-N 1 1 330.384 4.170 20 5 EIBDMO COc1cccc(Cl)c1C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000581082160 1021829267 /nfs/dbraw/zinc/82/92/67/1021829267.db2.gz KHLBQAKJCXQVGU-HNNXBMFYSA-N 1 1 332.787 4.034 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000581230420 1021837817 /nfs/dbraw/zinc/83/78/17/1021837817.db2.gz DUKCIEYNNVEWNI-YRBHFNIASA-N 1 1 328.334 4.272 20 5 EIBDMO Cc1c([C@H](C)[NH2+][C@H](C)c2nc3c(s2)CCC3)cccc1[N+](=O)[O-] ZINC000414133598 1021914686 /nfs/dbraw/zinc/91/46/86/1021914686.db2.gz AOQUNCBULIWIOB-NWDGAFQWSA-N 1 1 331.441 4.260 20 5 EIBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)c1 ZINC001167424405 1022314807 /nfs/dbraw/zinc/31/48/07/1022314807.db2.gz IQKSITBBCZMQOJ-HNNXBMFYSA-N 1 1 346.814 4.117 20 5 EIBDMO COc1ccc(CC2CC[NH+](Cc3csc([N+](=O)[O-])c3)CC2)cc1 ZINC000109962658 1022717925 /nfs/dbraw/zinc/71/79/25/1022717925.db2.gz UONUQQNPZWZBQT-UHFFFAOYSA-N 1 1 346.452 4.120 20 5 EIBDMO Cc1ccc(N[C@H](Cc2[nH+]ccn2C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000610468733 1022720250 /nfs/dbraw/zinc/72/02/50/1022720250.db2.gz UOGIFLIMNJZDQM-QGZVFWFLSA-N 1 1 336.395 4.033 20 5 EIBDMO CCc1nc2c(s1)[C@@H]([N@H+](C)Cc1cc(F)ccc1[N+](=O)[O-])CCC2 ZINC000177898794 1022816850 /nfs/dbraw/zinc/81/68/50/1022816850.db2.gz SFTGKEQIFGINKN-HNNXBMFYSA-N 1 1 349.431 4.262 20 5 EIBDMO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-])CCC2 ZINC000177898794 1022816858 /nfs/dbraw/zinc/81/68/58/1022816858.db2.gz SFTGKEQIFGINKN-HNNXBMFYSA-N 1 1 349.431 4.262 20 5 EIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000610481076 1022842682 /nfs/dbraw/zinc/84/26/82/1022842682.db2.gz UHMFZWXLBDSZMK-GOSISDBHSA-N 1 1 342.395 4.036 20 5 EIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000610481076 1022842684 /nfs/dbraw/zinc/84/26/84/1022842684.db2.gz UHMFZWXLBDSZMK-GOSISDBHSA-N 1 1 342.395 4.036 20 5 EIBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000511559407 1022860160 /nfs/dbraw/zinc/86/01/60/1022860160.db2.gz ZPFDMBQDWQUALY-HNNXBMFYSA-N 1 1 332.787 4.074 20 5 EIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000511559407 1022860164 /nfs/dbraw/zinc/86/01/64/1022860164.db2.gz ZPFDMBQDWQUALY-HNNXBMFYSA-N 1 1 332.787 4.074 20 5 EIBDMO Cc1cccc2c1OCC[C@@H]2[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000188950500 1022968901 /nfs/dbraw/zinc/96/89/01/1022968901.db2.gz IQUSQOAYUAGKOY-INIZCTEOSA-N 1 1 332.787 4.170 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000566592702 1023559462 /nfs/dbraw/zinc/55/94/62/1023559462.db2.gz JRPHBZMAAGCSTO-AZEVEFHYSA-N 1 1 342.439 4.032 20 5 EIBDMO COc1ccc(C[N@H+]2CCC[C@@](C)(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000500180753 1023572488 /nfs/dbraw/zinc/57/24/88/1023572488.db2.gz NMKMNVCKYCVHHS-HXUWFJFHSA-N 1 1 340.423 4.157 20 5 EIBDMO C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])s2)CC[N@H+]1Cc1ccccc1 ZINC000610573512 1023947093 /nfs/dbraw/zinc/94/70/93/1023947093.db2.gz NVHGEZBRZXKCPC-DZGCQCFKSA-N 1 1 331.441 4.121 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CC(C)(C)c1ccc(C)cc1 ZINC001167506223 1025572164 /nfs/dbraw/zinc/57/21/64/1025572164.db2.gz ZONIPGRYLZSRAQ-UHFFFAOYSA-N 1 1 342.439 4.321 20 5 EIBDMO CC[C@H](c1ccccc1OC)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1OC ZINC000561958915 1025739586 /nfs/dbraw/zinc/73/95/86/1025739586.db2.gz WEVYWEDUDAHSII-QGZVFWFLSA-N 1 1 344.411 4.195 20 5 EIBDMO CC[C@H](c1ccccc1OC)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1OC ZINC000561958915 1025739617 /nfs/dbraw/zinc/73/96/17/1025739617.db2.gz WEVYWEDUDAHSII-QGZVFWFLSA-N 1 1 344.411 4.195 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CC(c2nc3ccccc3s2)C1 ZINC000539142301 1025831989 /nfs/dbraw/zinc/83/19/89/1025831989.db2.gz KAAIHNPQMABWJF-GFCCVEGCSA-N 1 1 339.420 4.365 20 5 EIBDMO CC(C)c1ccc(C[NH2+][C@@H](c2ccccc2F)[C@H](C)O)cc1[N+](=O)[O-] ZINC000582185602 1026318831 /nfs/dbraw/zinc/31/88/31/1026318831.db2.gz RWUBSJVUJHPIJY-ORAYPTAESA-N 1 1 346.402 4.069 20 5 EIBDMO COCC[C@@H]([NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)c1ccc(C)o1 ZINC000478259785 1026534583 /nfs/dbraw/zinc/53/45/83/1026534583.db2.gz UYJQDSWLRMSELP-QGZVFWFLSA-N 1 1 346.427 4.487 20 5 EIBDMO Cc1c(C[NH2+][C@H](C)c2nc3c(s2)CCCC3)cccc1[N+](=O)[O-] ZINC000478500915 1026577173 /nfs/dbraw/zinc/57/71/73/1026577173.db2.gz WLHPCDHCIAYLEC-GFCCVEGCSA-N 1 1 331.441 4.089 20 5 EIBDMO C[C@H](c1ccccc1)[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CC1 ZINC000512266571 1026614437 /nfs/dbraw/zinc/61/44/37/1026614437.db2.gz BMDWQFIMTOUJES-CYBMUJFWSA-N 1 1 336.395 4.197 20 5 EIBDMO C[C@H](c1ccccc1)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CC1 ZINC000512266571 1026614446 /nfs/dbraw/zinc/61/44/46/1026614446.db2.gz BMDWQFIMTOUJES-CYBMUJFWSA-N 1 1 336.395 4.197 20 5 EIBDMO CC(C)(C)C[C@@H]1CCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000127700214 1026677848 /nfs/dbraw/zinc/67/78/48/1026677848.db2.gz AESNHCROZBAUKD-HNNXBMFYSA-N 1 1 344.415 4.045 20 5 EIBDMO C[C@@H]([NH2+]Cc1cccnc1OC1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000178644124 1027069984 /nfs/dbraw/zinc/06/99/84/1027069984.db2.gz KAINPDQJDGSXLF-CQSZACIVSA-N 1 1 341.411 4.162 20 5 EIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cccc(-c2ccccn2)c1 ZINC000579163103 1027246569 /nfs/dbraw/zinc/24/65/69/1027246569.db2.gz DVCUSWCKFHPJOT-UHFFFAOYSA-N 1 1 347.418 4.331 20 5 EIBDMO COc1ccc(C[N@H+]2C[C@H](C)C[C@@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000441353277 1027473525 /nfs/dbraw/zinc/47/35/25/1027473525.db2.gz YZIQWHZVAXRTHY-CXAGYDPISA-N 1 1 344.386 4.326 20 5 EIBDMO CO[C@]1(C)CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000475547764 1027585121 /nfs/dbraw/zinc/58/51/21/1027585121.db2.gz IFGDFZSXCAAOKO-LJQANCHMSA-N 1 1 344.411 4.246 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc2ccccc2n1 ZINC000178730587 1027773905 /nfs/dbraw/zinc/77/39/05/1027773905.db2.gz SADKPYLBZYJXFA-CYBMUJFWSA-N 1 1 337.379 4.002 20 5 EIBDMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000444661627 1027932063 /nfs/dbraw/zinc/93/20/63/1027932063.db2.gz IDZKVAFETDMAGP-DYVFJYSZSA-N 1 1 329.400 4.260 20 5 EIBDMO CC(C)[C@@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000444750835 1028036128 /nfs/dbraw/zinc/03/61/28/1028036128.db2.gz KOFSERQJUFAFJW-OAHLLOKOSA-N 1 1 329.400 4.118 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC4(C3)CCCCC4)co2)cc1 ZINC000536363070 1028142396 /nfs/dbraw/zinc/14/23/96/1028142396.db2.gz LFIIVGRDDUJTRA-UHFFFAOYSA-N 1 1 341.411 4.406 20 5 EIBDMO CC(C)([NH2+]Cc1cnc(C(F)(F)F)s1)c1ccc([N+](=O)[O-])cc1 ZINC000444005930 1028728217 /nfs/dbraw/zinc/72/82/17/1028728217.db2.gz ZHWUZFMSYWPTBL-UHFFFAOYSA-N 1 1 345.346 4.095 20 5 EIBDMO C[C@@H]([NH2+][C@@H](C)c1nccn1-c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000346948526 1028826947 /nfs/dbraw/zinc/82/69/47/1028826947.db2.gz QFZCHXSLWGBTML-CABCVRRESA-N 1 1 336.395 4.192 20 5 EIBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)CC1CCOCC1 ZINC000093284390 1029205160 /nfs/dbraw/zinc/20/51/60/1029205160.db2.gz SEOUXZOIKZSPCL-UHFFFAOYSA-N 1 1 346.452 4.182 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[C@@H]4CC[C@@]43c3cccnc3)c2c1 ZINC000897071921 1029340515 /nfs/dbraw/zinc/34/05/15/1029340515.db2.gz ZVZXAILRADZBID-XOBRGWDASA-N 1 1 346.390 4.054 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCCC4(CCC4)C3)cs2)c1 ZINC000475288269 1029500503 /nfs/dbraw/zinc/50/05/03/1029500503.db2.gz YIIAPWMNCSMTCI-UHFFFAOYSA-N 1 1 343.452 4.484 20 5 EIBDMO CCOc1ccc2c(c1)CC[N@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000441067306 1029508565 /nfs/dbraw/zinc/50/85/65/1029508565.db2.gz QHABBGNOADBEDG-AWEZNQCLSA-N 1 1 326.396 4.113 20 5 EIBDMO CCOc1ccc2c(c1)CC[N@@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000441067306 1029508570 /nfs/dbraw/zinc/50/85/70/1029508570.db2.gz QHABBGNOADBEDG-AWEZNQCLSA-N 1 1 326.396 4.113 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](CSc3ccccc3)C2)cs1 ZINC000525267373 1029553250 /nfs/dbraw/zinc/55/32/50/1029553250.db2.gz GEVGJKSKWNSTGR-CYBMUJFWSA-N 1 1 334.466 4.271 20 5 EIBDMO CC(C)c1noc([C@@H](C)[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451546441 1030563590 /nfs/dbraw/zinc/56/35/90/1030563590.db2.gz JHXMZEOAFRGECE-UKRRQHHQSA-N 1 1 344.415 4.042 20 5 EIBDMO CC(C)c1noc([C@@H](C)[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451546441 1030563609 /nfs/dbraw/zinc/56/36/09/1030563609.db2.gz JHXMZEOAFRGECE-UKRRQHHQSA-N 1 1 344.415 4.042 20 5 EIBDMO CCCCOc1ncccc1C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000532462939 1031128664 /nfs/dbraw/zinc/12/86/64/1031128664.db2.gz ARTGCMMIBFLKAR-OAHLLOKOSA-N 1 1 343.427 4.328 20 5 EIBDMO COc1cccc(Cl)c1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000188470731 1031223949 /nfs/dbraw/zinc/22/39/49/1031223949.db2.gz KYQSKZCSPBPNFR-GFCCVEGCSA-N 1 1 334.803 4.416 20 5 EIBDMO Cc1cc(C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c2ccccc2n1 ZINC000531782009 1031598847 /nfs/dbraw/zinc/59/88/47/1031598847.db2.gz JWAMHTAWVQMNBD-UHFFFAOYSA-N 1 1 333.391 4.010 20 5 EIBDMO Cc1cc(C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c2ccccc2n1 ZINC000531782009 1031598852 /nfs/dbraw/zinc/59/88/52/1031598852.db2.gz JWAMHTAWVQMNBD-UHFFFAOYSA-N 1 1 333.391 4.010 20 5 EIBDMO Cc1cccc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1F ZINC000449287472 1031599487 /nfs/dbraw/zinc/59/94/87/1031599487.db2.gz KVRMDLBDLDWYMI-UHFFFAOYSA-N 1 1 342.292 4.351 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccccc2OC(F)F)C2CC2)c1 ZINC000532021404 1031986293 /nfs/dbraw/zinc/98/62/93/1031986293.db2.gz IUOQYSXFPMMZEY-UHFFFAOYSA-N 1 1 348.349 4.361 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccccc2OC(F)F)C2CC2)c1 ZINC000532021404 1031986306 /nfs/dbraw/zinc/98/63/06/1031986306.db2.gz IUOQYSXFPMMZEY-UHFFFAOYSA-N 1 1 348.349 4.361 20 5 EIBDMO C[C@@H]1CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H]1C ZINC000512643513 1033598104 /nfs/dbraw/zinc/59/81/04/1033598104.db2.gz DMZRZZMACMCFLU-OLZOCXBDSA-N 1 1 331.441 4.339 20 5 EIBDMO CC(C)[N@@H+](CCc1nccs1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000182362936 1034894343 /nfs/dbraw/zinc/89/43/43/1034894343.db2.gz PASUKFZKWNSQHX-UHFFFAOYSA-N 1 1 339.848 4.158 20 5 EIBDMO CCc1nccn1[C@@H]1CCC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000182759762 1034989016 /nfs/dbraw/zinc/98/90/16/1034989016.db2.gz IKHWHUBLGMWKLH-DOTOQJQBSA-N 1 1 342.443 4.060 20 5 EIBDMO CCOc1cc(C)ccc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595018386 1035507463 /nfs/dbraw/zinc/50/74/63/1035507463.db2.gz NLJWNNLOURKSGW-CQSZACIVSA-N 1 1 344.411 4.161 20 5 EIBDMO COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1F ZINC000595002927 1035523445 /nfs/dbraw/zinc/52/34/45/1035523445.db2.gz BQVOTKVWWUHVFC-RYUDHWBXSA-N 1 1 348.374 4.163 20 5 EIBDMO COc1ccccc1[C@@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595003300 1035525669 /nfs/dbraw/zinc/52/56/69/1035525669.db2.gz GMBCBCHPVMJHNM-CHWSQXEVSA-N 1 1 330.384 4.024 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccc(F)c(Cl)c1 ZINC000595029902 1035560297 /nfs/dbraw/zinc/56/02/97/1035560297.db2.gz AHXQFNJQTPIBLB-SNVBAGLBSA-N 1 1 338.766 4.247 20 5 EIBDMO Cc1noc(C[NH2+][C@H](c2ccc(F)cc2)C2CCCC2)c1[N+](=O)[O-] ZINC000595416972 1035674262 /nfs/dbraw/zinc/67/42/62/1035674262.db2.gz WEDSJNGVAQPIDL-INIZCTEOSA-N 1 1 333.363 4.051 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]([C@@H]3CCCCO3)C2)c(Cl)c1 ZINC000595787995 1035792521 /nfs/dbraw/zinc/79/25/21/1035792521.db2.gz LQJIYPMQYUZWGM-YOEHRIQHSA-N 1 1 338.835 4.029 20 5 EIBDMO COc1cccc(C2=CC[N@H+](Cc3ccc([N+](=O)[O-])cc3F)CC2)c1 ZINC000491128353 1035813795 /nfs/dbraw/zinc/81/37/95/1035813795.db2.gz AKXSSKWOCODHRC-UHFFFAOYSA-N 1 1 342.370 4.032 20 5 EIBDMO COc1cccc(C2=CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3F)CC2)c1 ZINC000491128353 1035813798 /nfs/dbraw/zinc/81/37/98/1035813798.db2.gz AKXSSKWOCODHRC-UHFFFAOYSA-N 1 1 342.370 4.032 20 5 EIBDMO C[C@@H]([NH2+][C@H]1CCc2ccccc2-n2ccnc21)c1ccc([N+](=O)[O-])cc1 ZINC000596094000 1035821738 /nfs/dbraw/zinc/82/17/38/1035821738.db2.gz FZLRPAXRISVVGU-KDOFPFPSSA-N 1 1 348.406 4.119 20 5 EIBDMO C[C@H]([NH2+][C@@H]1CCc2ccccc2-n2ccnc21)c1cccc([N+](=O)[O-])c1 ZINC000596093737 1035821832 /nfs/dbraw/zinc/82/18/32/1035821832.db2.gz FTGNZBSKUYCGIS-KBXCAEBGSA-N 1 1 348.406 4.119 20 5 EIBDMO COc1cc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)ccc1[N+](=O)[O-] ZINC000485720868 1036205481 /nfs/dbraw/zinc/20/54/81/1036205481.db2.gz ZBDACPRLIXDWBD-MRXNPFEDSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1cc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)ccc1[N+](=O)[O-] ZINC000485720868 1036205491 /nfs/dbraw/zinc/20/54/91/1036205491.db2.gz ZBDACPRLIXDWBD-MRXNPFEDSA-N 1 1 330.359 4.080 20 5 EIBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCC1(F)F ZINC000588232574 1036306298 /nfs/dbraw/zinc/30/62/98/1036306298.db2.gz OLIGMEQGVKCERD-FZMZJTMJSA-N 1 1 330.400 4.243 20 5 EIBDMO CC1(C)C[C@@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)c2ccccc21 ZINC000602576453 1036505743 /nfs/dbraw/zinc/50/57/43/1036505743.db2.gz NTPVLDXHUWMZBF-MRXNPFEDSA-N 1 1 337.379 4.248 20 5 EIBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1Br ZINC000034996168 1036506428 /nfs/dbraw/zinc/50/64/28/1036506428.db2.gz QHKKPBHEBYEQOC-NSHDSACASA-N 1 1 335.201 4.208 20 5 EIBDMO O=[N+]([O-])c1cccc(C[NH2+]Cc2cc(F)c(C(F)(F)F)cc2F)c1 ZINC000588929760 1036606552 /nfs/dbraw/zinc/60/65/52/1036606552.db2.gz DFJFECGJRYRGKH-UHFFFAOYSA-N 1 1 346.255 4.182 20 5 EIBDMO c1ccc2c(c1)cc1ccccc1c2C[NH2+]CCCCN1CCOCC1 ZINC000060996352 1036760254 /nfs/dbraw/zinc/76/02/54/1036760254.db2.gz AWNHHRBBKGUTLY-UHFFFAOYSA-N 1 1 348.490 4.195 20 5 EIBDMO C[N@@H+](CCSc1ccc(Cl)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000603581610 1036893680 /nfs/dbraw/zinc/89/36/80/1036893680.db2.gz XFKYGXRXPANYQP-UHFFFAOYSA-N 1 1 336.844 4.472 20 5 EIBDMO CC[N@H+](CCC(F)(F)F)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000590157693 1036993758 /nfs/dbraw/zinc/99/37/58/1036993758.db2.gz BUQXVQMDUQZSDR-UHFFFAOYSA-N 1 1 344.255 4.388 20 5 EIBDMO CC[N@@H+](CCC(F)(F)F)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000590157693 1036993782 /nfs/dbraw/zinc/99/37/82/1036993782.db2.gz BUQXVQMDUQZSDR-UHFFFAOYSA-N 1 1 344.255 4.388 20 5 EIBDMO C[N@H+](Cc1ccsc1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000590154564 1036994051 /nfs/dbraw/zinc/99/40/51/1036994051.db2.gz OOBCUHRUDUIYPJ-UHFFFAOYSA-N 1 1 330.331 4.307 20 5 EIBDMO C[N@@H+](Cc1ccsc1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000590154564 1036994063 /nfs/dbraw/zinc/99/40/63/1036994063.db2.gz OOBCUHRUDUIYPJ-UHFFFAOYSA-N 1 1 330.331 4.307 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3ncccc3Cl)C2)cc1 ZINC000599434330 1037010137 /nfs/dbraw/zinc/01/01/37/1037010137.db2.gz YZEHZBWVTNZPME-CQSZACIVSA-N 1 1 331.803 4.023 20 5 EIBDMO Cc1ccccc1[C@@H]1CCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000603856935 1037053100 /nfs/dbraw/zinc/05/31/00/1037053100.db2.gz GDBUJQQFKQMRFZ-KRWDZBQOSA-N 1 1 326.396 4.119 20 5 EIBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@@H]2c2cccs2)cc1 ZINC000604012605 1037147120 /nfs/dbraw/zinc/14/71/20/1037147120.db2.gz VRTIFTIBEOAUHL-MRXNPFEDSA-N 1 1 332.425 4.262 20 5 EIBDMO C[N@H+](Cc1cccc([N+](=O)[O-])c1)C[C@H]1CCCO[C@H]1c1ccccc1 ZINC000604521170 1037404494 /nfs/dbraw/zinc/40/44/94/1037404494.db2.gz AIUASQZZGBFPHP-QUCCMNQESA-N 1 1 340.423 4.195 20 5 EIBDMO C[C@H](N[C@H]1CCC[NH2+]CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000591578331 1037505913 /nfs/dbraw/zinc/50/59/13/1037505913.db2.gz RGEGGTAHJCQEHT-KBPBESRZSA-N 1 1 345.468 4.116 20 5 EIBDMO CC(C)c1ccc(C[NH2+][C@H](CCO)c2ccccc2F)cc1[N+](=O)[O-] ZINC000592376397 1037777743 /nfs/dbraw/zinc/77/77/43/1037777743.db2.gz JJDYWVRGFQPKNY-GOSISDBHSA-N 1 1 346.402 4.071 20 5 EIBDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000574319036 1038171719 /nfs/dbraw/zinc/17/17/19/1038171719.db2.gz BMHRLNHGYGDXCQ-KRWDZBQOSA-N 1 1 342.443 4.395 20 5 EIBDMO CC[C@H]1c2ccsc2CC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000058933215 1038204918 /nfs/dbraw/zinc/20/49/18/1038204918.db2.gz NFXHAELYCTWKDL-INIZCTEOSA-N 1 1 332.425 4.045 20 5 EIBDMO C[C@H](NCCC[NH2+]C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423532869 1038268859 /nfs/dbraw/zinc/26/88/59/1038268859.db2.gz WCCHWXHRQIFQCX-ZDUSSCGKSA-N 1 1 345.468 4.116 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](Nc2ccccc2)C1 ZINC000489975394 1038293960 /nfs/dbraw/zinc/29/39/60/1038293960.db2.gz DFXYMEBPFGTKIG-NVXWUHKLSA-N 1 1 325.412 4.151 20 5 EIBDMO COc1ccc([C@H]2CC[N@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000504519955 1038393503 /nfs/dbraw/zinc/39/35/03/1038393503.db2.gz BHJUEKPURFIZGB-YOEHRIQHSA-N 1 1 326.396 4.154 20 5 EIBDMO C[C@H]1CC[C@H](C)[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000537619623 1038950146 /nfs/dbraw/zinc/95/01/46/1038950146.db2.gz HQHFWUWTEWNRTK-STQMWFEESA-N 1 1 331.441 4.339 20 5 EIBDMO Cc1c(NC(=O)CC[N@H+]2CCCC23CCCCC3)cccc1[N+](=O)[O-] ZINC000533993271 1039021344 /nfs/dbraw/zinc/02/13/44/1039021344.db2.gz SJEUGFQSKUSJDO-UHFFFAOYSA-N 1 1 345.443 4.031 20 5 EIBDMO CC(C)C[C@@H]1CCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000534113815 1039115008 /nfs/dbraw/zinc/11/50/08/1039115008.db2.gz HTOPHBKLTLPZLO-KRWDZBQOSA-N 1 1 329.400 4.260 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+](CCO)C3CCCC3)s2)cc1 ZINC000505273635 1039184394 /nfs/dbraw/zinc/18/43/94/1039184394.db2.gz OXPVRIOFMKYQOG-UHFFFAOYSA-N 1 1 346.452 4.060 20 5 EIBDMO CC(C)c1ccc(C[N@@H+]2CCC[C@H]2c2ccccn2)cc1[N+](=O)[O-] ZINC000535067587 1039927274 /nfs/dbraw/zinc/92/72/74/1039927274.db2.gz QGHGWHOEDPKVNV-SFHVURJKSA-N 1 1 325.412 4.450 20 5 EIBDMO CC(C)c1ccc(C[N@H+]2CCC[C@H]2c2ccccn2)cc1[N+](=O)[O-] ZINC000535067587 1039927297 /nfs/dbraw/zinc/92/72/97/1039927297.db2.gz QGHGWHOEDPKVNV-SFHVURJKSA-N 1 1 325.412 4.450 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccnc2ccccc12)C1CC1 ZINC000535072351 1039941352 /nfs/dbraw/zinc/94/13/52/1039941352.db2.gz LKCZDYWCUXDGGP-UHFFFAOYSA-N 1 1 333.391 4.308 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccnc2ccccc12)C1CC1 ZINC000535072351 1039941372 /nfs/dbraw/zinc/94/13/72/1039941372.db2.gz LKCZDYWCUXDGGP-UHFFFAOYSA-N 1 1 333.391 4.308 20 5 EIBDMO C[C@H](N[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000482314540 1040164617 /nfs/dbraw/zinc/16/46/17/1040164617.db2.gz KAZUFHRIVPBCSY-BXWFABGCSA-N 1 1 339.439 4.081 20 5 EIBDMO C[C@H](N[C@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000482314540 1040164649 /nfs/dbraw/zinc/16/46/49/1040164649.db2.gz KAZUFHRIVPBCSY-BXWFABGCSA-N 1 1 339.439 4.081 20 5 EIBDMO C[C@@H]1c2ccccc2CC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000535556608 1040366411 /nfs/dbraw/zinc/36/64/11/1040366411.db2.gz HPRTUFSWSBRVIP-CQSZACIVSA-N 1 1 349.390 4.369 20 5 EIBDMO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000535556608 1040366425 /nfs/dbraw/zinc/36/64/25/1040366425.db2.gz HPRTUFSWSBRVIP-CQSZACIVSA-N 1 1 349.390 4.369 20 5 EIBDMO CC[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)Cc1ccccc1 ZINC000089882815 1040491604 /nfs/dbraw/zinc/49/16/04/1040491604.db2.gz DMYOKLKTGJHKLK-UHFFFAOYSA-N 1 1 337.379 4.272 20 5 EIBDMO CC[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)Cc1ccccc1 ZINC000089882815 1040491612 /nfs/dbraw/zinc/49/16/12/1040491612.db2.gz DMYOKLKTGJHKLK-UHFFFAOYSA-N 1 1 337.379 4.272 20 5 EIBDMO CC(C)[N@@H+](CCC(=O)c1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000539720964 1040736681 /nfs/dbraw/zinc/73/66/81/1040736681.db2.gz HOLVXVFLVKLWAN-UHFFFAOYSA-N 1 1 326.396 4.078 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+](CC3CC3)CC3CCC3)co2)cc1 ZINC000483270324 1040801804 /nfs/dbraw/zinc/80/18/04/1040801804.db2.gz OQHSOYJMBZKDJP-UHFFFAOYSA-N 1 1 341.411 4.262 20 5 EIBDMO C[C@@H](CCO)[N@@H+](Cc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000540054594 1041076963 /nfs/dbraw/zinc/07/69/63/1041076963.db2.gz ZJUHJYSAPYWBJK-AWEZNQCLSA-N 1 1 348.830 4.021 20 5 EIBDMO C[C@H](NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000436310527 1041098166 /nfs/dbraw/zinc/09/81/66/1041098166.db2.gz RMNMNECFZPGYJX-KXBFYZLASA-N 1 1 331.460 4.043 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425554044 1041250662 /nfs/dbraw/zinc/25/06/62/1041250662.db2.gz NVNCMZAVJALWFT-BEFAXECRSA-N 1 1 344.455 4.245 20 5 EIBDMO COc1cc(C[N@H+]2CC[C@H](c3ccccc3C)C2)c([N+](=O)[O-])cc1F ZINC000464097235 1041861620 /nfs/dbraw/zinc/86/16/20/1041861620.db2.gz FNGDJRPMUQGNFT-AWEZNQCLSA-N 1 1 344.386 4.040 20 5 EIBDMO COc1cccc(F)c1[C@@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000122438903 1041956913 /nfs/dbraw/zinc/95/69/13/1041956913.db2.gz TVVWSUGZMGQGKD-QWHCGFSZSA-N 1 1 332.375 4.463 20 5 EIBDMO C[N@@H+](CC[C@H]1CCCO1)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000467366367 1042050096 /nfs/dbraw/zinc/05/00/96/1042050096.db2.gz AFKQZBXVQXMOFD-CQSZACIVSA-N 1 1 346.452 4.324 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1cccs1)C[C@H]1CCCO1 ZINC000541770709 1042108263 /nfs/dbraw/zinc/10/82/63/1042108263.db2.gz IPGVRSXIKIBNAT-QGZVFWFLSA-N 1 1 346.452 4.146 20 5 EIBDMO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)s1 ZINC000541772507 1042109315 /nfs/dbraw/zinc/10/93/15/1042109315.db2.gz CNLZGCBKKWSSKG-ZDUSSCGKSA-N 1 1 333.457 4.424 20 5 EIBDMO CCC[C@H]1[C@@H](C)CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000464731288 1042135648 /nfs/dbraw/zinc/13/56/48/1042135648.db2.gz GXRHDSPFUVMPHE-BBRMVZONSA-N 1 1 344.415 4.045 20 5 EIBDMO COc1cccc(F)c1[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000122462670 1042142354 /nfs/dbraw/zinc/14/23/54/1042142354.db2.gz YNUWVSBQQPXAII-QWHCGFSZSA-N 1 1 332.375 4.463 20 5 EIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](C(C)(C)C)C1 ZINC000542320319 1042387585 /nfs/dbraw/zinc/38/75/85/1042387585.db2.gz GBCBAMHJYRXUEL-OCCSQVGLSA-N 1 1 344.415 4.074 20 5 EIBDMO CCC[N@@H+](C)Cc1ccc(OC)c(OCc2ccc([N+](=O)[O-])cc2)c1 ZINC000506449964 1042436478 /nfs/dbraw/zinc/43/64/78/1042436478.db2.gz BVIOCRLGMASAPD-UHFFFAOYSA-N 1 1 344.411 4.024 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000506482774 1042497529 /nfs/dbraw/zinc/49/75/29/1042497529.db2.gz UOXDJYWZXZCNFT-FGTMMUONSA-N 1 1 345.487 4.242 20 5 EIBDMO CC(C)c1ccc(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000446974784 1042501145 /nfs/dbraw/zinc/50/11/45/1042501145.db2.gz LTENSNQEQGBUKW-ZDUSSCGKSA-N 1 1 330.350 4.493 20 5 EIBDMO C[C@H](c1cccc(Cl)c1)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000518459458 1042531870 /nfs/dbraw/zinc/53/18/70/1042531870.db2.gz LNKDXGVPPXWGAW-CYBMUJFWSA-N 1 1 334.803 4.320 20 5 EIBDMO Cc1csc(C2([NH2+][C@@H](C)c3cc([N+](=O)[O-])ccc3C)CCC2)n1 ZINC000271933398 1042534618 /nfs/dbraw/zinc/53/46/18/1042534618.db2.gz FFEZLQCOADMDCX-ZDUSSCGKSA-N 1 1 331.441 4.398 20 5 EIBDMO CC(C)([NH2+]Cc1cc(-c2ccccc2)n[nH]1)c1ccccc1[N+](=O)[O-] ZINC000492103989 1042557505 /nfs/dbraw/zinc/55/75/05/1042557505.db2.gz JVDIUIYONZIUNK-UHFFFAOYSA-N 1 1 336.395 4.010 20 5 EIBDMO COc1ccc2oc(C[NH2+]C(C)(C)c3ccccc3[N+](=O)[O-])cc2c1 ZINC000492194956 1042575750 /nfs/dbraw/zinc/57/57/50/1042575750.db2.gz UFNIHRNHFSAYKX-UHFFFAOYSA-N 1 1 340.379 4.375 20 5 EIBDMO Cc1csc(C2([NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3C)CCC2)n1 ZINC000271971345 1042593078 /nfs/dbraw/zinc/59/30/78/1042593078.db2.gz NBFNNRHSLDVNJM-ZDUSSCGKSA-N 1 1 331.441 4.398 20 5 EIBDMO CCOc1cc(C[N@H+](C)Cc2ccc(Cl)s2)ccc1[N+](=O)[O-] ZINC000492377204 1042625627 /nfs/dbraw/zinc/62/56/27/1042625627.db2.gz PMPYKKLPUXTQBW-UHFFFAOYSA-N 1 1 340.832 4.340 20 5 EIBDMO CCOc1cc(C[N@@H+](C)Cc2ccc(Cl)s2)ccc1[N+](=O)[O-] ZINC000492377204 1042625635 /nfs/dbraw/zinc/62/56/35/1042625635.db2.gz PMPYKKLPUXTQBW-UHFFFAOYSA-N 1 1 340.832 4.340 20 5 EIBDMO CCOc1cc(C[N@@H+](CC)[C@H](C)c2cccc(O)c2)ccc1[N+](=O)[O-] ZINC000492789823 1042749885 /nfs/dbraw/zinc/74/98/85/1042749885.db2.gz NEGHGQOWWGCTFT-CQSZACIVSA-N 1 1 344.411 4.282 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)cc1Cl ZINC000761513614 1042874722 /nfs/dbraw/zinc/87/47/22/1042874722.db2.gz AXKAMLYGJPVZBV-LSDHHAIUSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)cc1Cl ZINC000761513614 1042874723 /nfs/dbraw/zinc/87/47/23/1042874723.db2.gz AXKAMLYGJPVZBV-LSDHHAIUSA-N 1 1 326.849 4.108 20 5 EIBDMO COc1ccc([C@@H]2CC[N@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])C2)cc1 ZINC000441535011 1042878162 /nfs/dbraw/zinc/87/81/62/1042878162.db2.gz OKBOXZCWPPBQGD-GOEBONIOSA-N 1 1 326.396 4.154 20 5 EIBDMO CCC(C)(C)[C@H]1CCC[N@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000441653931 1042957708 /nfs/dbraw/zinc/95/77/08/1042957708.db2.gz CHYXUFRKFPZVAD-QGZVFWFLSA-N 1 1 347.459 4.132 20 5 EIBDMO Cc1cnc([C@H]([NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)C2CC2)s1 ZINC000120940585 1043088506 /nfs/dbraw/zinc/08/85/06/1043088506.db2.gz DIWYDOWPGYYLNL-MLGOLLRUSA-N 1 1 331.441 4.470 20 5 EIBDMO CCOc1ccc(C[N@H+](Cc2csc([N+](=O)[O-])c2)C(C)C)cc1 ZINC000521822628 1044014597 /nfs/dbraw/zinc/01/45/97/1044014597.db2.gz ZXFZYIJXLSIHGG-UHFFFAOYSA-N 1 1 334.441 4.466 20 5 EIBDMO CCOc1ccc(C[N@@H+](Cc2csc([N+](=O)[O-])c2)C(C)C)cc1 ZINC000521822628 1044014614 /nfs/dbraw/zinc/01/46/14/1044014614.db2.gz ZXFZYIJXLSIHGG-UHFFFAOYSA-N 1 1 334.441 4.466 20 5 EIBDMO Cc1ccccc1[C@@H]([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)C1CC1 ZINC000509007255 1044156804 /nfs/dbraw/zinc/15/68/04/1044156804.db2.gz PUFHDBNHPOIUSP-SFHVURJKSA-N 1 1 332.350 4.422 20 5 EIBDMO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccncc1)c1cccc([N+](=O)[O-])c1 ZINC000173980886 1044202137 /nfs/dbraw/zinc/20/21/37/1044202137.db2.gz UUXOIVXUMCFYKE-QRWLVFNGSA-N 1 1 333.391 4.430 20 5 EIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+](CCc1cccc(F)c1)C1CC1 ZINC000733797067 1044313350 /nfs/dbraw/zinc/31/33/50/1044313350.db2.gz OBURUGHMCRROFO-UHFFFAOYSA-N 1 1 332.350 4.080 20 5 EIBDMO CCC[C@@H]1CCC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000246564538 1044332580 /nfs/dbraw/zinc/33/25/80/1044332580.db2.gz NLPBRWYHTWKFTP-ZIAGYGMSSA-N 1 1 344.415 4.218 20 5 EIBDMO Cc1ccc(C2CC[NH+](Cc3c(Cl)cccc3[N+](=O)[O-])CC2)cn1 ZINC000494824768 1044401739 /nfs/dbraw/zinc/40/17/39/1044401739.db2.gz PRQVTKRIKSOTRI-UHFFFAOYSA-N 1 1 345.830 4.331 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(F)c3cccnc23)c(Cl)c1 ZINC000466457020 1044530553 /nfs/dbraw/zinc/53/05/53/1044530553.db2.gz UCCVZQUJGDHDSB-UHFFFAOYSA-N 1 1 345.761 4.225 20 5 EIBDMO C[C@@H](C1CCCCC1)[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000282351757 1044531124 /nfs/dbraw/zinc/53/11/24/1044531124.db2.gz CQSUOKCJUDJULR-ZDUSSCGKSA-N 1 1 344.415 4.045 20 5 EIBDMO Cc1ccc(CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cn1 ZINC000474147935 1044686171 /nfs/dbraw/zinc/68/61/71/1044686171.db2.gz SXSVPLONUVDRKJ-UHFFFAOYSA-N 1 1 327.428 4.141 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC000734836382 1044695183 /nfs/dbraw/zinc/69/51/83/1044695183.db2.gz CUTAHDIRUXOXGI-ZDUSSCGKSA-N 1 1 334.778 4.377 20 5 EIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+](CCc1ccc(F)cc1)C1CC1 ZINC000735168126 1044755608 /nfs/dbraw/zinc/75/56/08/1044755608.db2.gz INMMBBBHWYPVPT-UHFFFAOYSA-N 1 1 332.350 4.080 20 5 EIBDMO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1ccc([N+](=O)[O-])cc1 ZINC000154642678 1044821521 /nfs/dbraw/zinc/82/15/21/1044821521.db2.gz AAFSEUMQDQGXGA-FOIQADDNSA-N 1 1 333.391 4.430 20 5 EIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+](CCCCO)C3CC3)s2)cc1 ZINC000093383046 1044834850 /nfs/dbraw/zinc/83/48/50/1044834850.db2.gz AMQODBOOBXZDBK-UHFFFAOYSA-N 1 1 346.452 4.060 20 5 EIBDMO CC(C)[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CCC1 ZINC000093608247 1044844921 /nfs/dbraw/zinc/84/49/21/1044844921.db2.gz HOEZRYSQNUERQB-UHFFFAOYSA-N 1 1 331.441 4.481 20 5 EIBDMO CN(C)c1cccc([C@@H]2CCC[N@@H+]2Cc2c(F)cccc2[N+](=O)[O-])c1 ZINC000735873325 1044871469 /nfs/dbraw/zinc/87/14/69/1044871469.db2.gz IWULCPMGTNDILP-SFHVURJKSA-N 1 1 343.402 4.137 20 5 EIBDMO CN(C)c1cccc([C@@H]2CCC[N@H+]2Cc2c(F)cccc2[N+](=O)[O-])c1 ZINC000735873325 1044871473 /nfs/dbraw/zinc/87/14/73/1044871473.db2.gz IWULCPMGTNDILP-SFHVURJKSA-N 1 1 343.402 4.137 20 5 EIBDMO CC[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCCO1 ZINC000467561980 1045020350 /nfs/dbraw/zinc/02/03/50/1045020350.db2.gz IEDSBUORIQQHPH-CQSZACIVSA-N 1 1 346.452 4.324 20 5 EIBDMO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccncc1)c1ccc([N+](=O)[O-])cc1 ZINC000156287330 1045034488 /nfs/dbraw/zinc/03/44/88/1045034488.db2.gz ZLQKAEKLURSYNT-QRWLVFNGSA-N 1 1 333.391 4.430 20 5 EIBDMO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccncc1)c1ccc([N+](=O)[O-])cc1 ZINC000156287506 1045034578 /nfs/dbraw/zinc/03/45/78/1045034578.db2.gz 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Cc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)cc1Cl ZINC000767692027 1045616559 /nfs/dbraw/zinc/61/65/59/1045616559.db2.gz SQKIOYCOFSIWEO-UHFFFAOYSA-N 1 1 325.195 4.500 20 5 EIBDMO CC[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000767829995 1045650004 /nfs/dbraw/zinc/65/00/04/1045650004.db2.gz GYHWXALZQOGTIC-INIZCTEOSA-N 1 1 348.830 4.021 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000609233599 1045698794 /nfs/dbraw/zinc/69/87/94/1045698794.db2.gz GSPJKJVQTHZASV-DNVCBOLYSA-N 1 1 326.396 4.119 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+](C[C@@H]2CCCO2)C2CCCC2)ccc1Cl ZINC000768555248 1045818890 /nfs/dbraw/zinc/81/88/90/1045818890.db2.gz PBKHQCIBPIECSQ-HNNXBMFYSA-N 1 1 338.835 4.172 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCS[C@H]3CCCC[C@@H]32)ccc1Cl ZINC000768549106 1045822717 /nfs/dbraw/zinc/82/27/17/1045822717.db2.gz OPIPHDRERLYUHD-ZFWWWQNUSA-N 1 1 326.849 4.108 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)ccc1Cl ZINC000768549106 1045822722 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1 1 334.803 4.067 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccc(F)cc2)CC2CC2)cc1F ZINC000788482836 1047198196 /nfs/dbraw/zinc/19/81/96/1047198196.db2.gz YKMQJKDVEVLLQR-UHFFFAOYSA-N 1 1 332.350 4.285 20 5 EIBDMO COc1ccccc1[C@@H]1CCCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000609280890 1047482507 /nfs/dbraw/zinc/48/25/07/1047482507.db2.gz UMQVXXWRCPJUBV-SFHVURJKSA-N 1 1 326.396 4.331 20 5 EIBDMO COc1ccc([C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])c2ccccc2)cc1 ZINC000194809027 1047746318 /nfs/dbraw/zinc/74/63/18/1047746318.db2.gz OEQLVQWCKJMAIG-OAQYLSRUSA-N 1 1 348.402 4.483 20 5 EIBDMO Cc1c(C[N@H+]2CC[C@H](Oc3ccc(Cl)cc3)C2)cccc1[N+](=O)[O-] ZINC001170593409 1048594386 /nfs/dbraw/zinc/59/43/86/1048594386.db2.gz LHPBSAZCFYCEBH-KRWDZBQOSA-N 1 1 346.814 4.210 20 5 EIBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+]1CCCCC[C@H]1CCO ZINC000810011350 1048601101 /nfs/dbraw/zinc/60/11/01/1048601101.db2.gz IFUMAHFVZUDHJO-ZDUSSCGKSA-N 1 1 347.242 4.029 20 5 EIBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@@H+]1CCCCC[C@H]1CCO ZINC000810011350 1048601111 /nfs/dbraw/zinc/60/11/11/1048601111.db2.gz IFUMAHFVZUDHJO-ZDUSSCGKSA-N 1 1 347.242 4.029 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@]3(CC3(F)F)C2)o1 ZINC000846108853 1048814473 /nfs/dbraw/zinc/81/44/73/1048814473.db2.gz RYFBXHQZBLOMEE-KRWDZBQOSA-N 1 1 348.349 4.476 20 5 EIBDMO CC1(C)[C@@H](c2ccccc2)CC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC001171266910 1049002321 /nfs/dbraw/zinc/00/23/21/1049002321.db2.gz LFPDCKWJYANVTP-QGZVFWFLSA-N 1 1 340.423 4.242 20 5 EIBDMO CC(C)([NH2+]Cc1ccc(-c2ccccn2)nc1)c1ccccc1[N+](=O)[O-] ZINC001170650218 1049330722 /nfs/dbraw/zinc/33/07/22/1049330722.db2.gz HFBBYNIAXKQJGD-UHFFFAOYSA-N 1 1 348.406 4.077 20 5 EIBDMO Cc1c(C[N@@H+]2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000609916541 1049395624 /nfs/dbraw/zinc/39/56/24/1049395624.db2.gz WOKHAKDQRYAPKR-GUYCJALGSA-N 1 1 328.387 4.420 20 5 EIBDMO C[C@@H]1C[C@@H](N(C)c2ccccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000609964758 1049422183 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IMSKPNSVAZFCIX-AWEZNQCLSA-N 1 1 346.349 4.027 20 5 EIBDMO CCOc1cc(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)ccc1[N+](=O)[O-] ZINC000617210278 1049967910 /nfs/dbraw/zinc/96/79/10/1049967910.db2.gz IGWWMBQHCOMKCW-KRWDZBQOSA-N 1 1 342.395 4.036 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1cccc2cccnc21 ZINC001173226416 1050356281 /nfs/dbraw/zinc/35/62/81/1050356281.db2.gz KBXNWZYGTPWZPA-OAHLLOKOSA-N 1 1 335.407 4.206 20 5 EIBDMO Cc1ccc(C[N@H+]2CC[C@@H](Nc3ccc(Cl)cc3[N+](=O)[O-])C2)cc1 ZINC001187393403 1050540809 /nfs/dbraw/zinc/54/08/09/1050540809.db2.gz YRRZWYLLTJJUPY-MRXNPFEDSA-N 1 1 345.830 4.243 20 5 EIBDMO C[C@H]1Cc2cc(C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C3CC3)ccc2O1 ZINC001179909032 1050831505 /nfs/dbraw/zinc/83/15/05/1050831505.db2.gz AVKMODGXMUKDQD-AWEZNQCLSA-N 1 1 338.407 4.083 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@H]2Cc2ccc(F)cc2)c(F)c1 ZINC001180185521 1050898149 /nfs/dbraw/zinc/89/81/49/1050898149.db2.gz ZRWUYJRQSLLOLJ-KRWDZBQOSA-N 1 1 346.377 4.470 20 5 EIBDMO CC(C)[C@H]1CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001180950529 1051119872 /nfs/dbraw/zinc/11/98/72/1051119872.db2.gz BWNJRRMFORTBLF-LBPRGKRZSA-N 1 1 330.350 4.482 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC001190393247 1051167150 /nfs/dbraw/zinc/16/71/50/1051167150.db2.gz ZIXBAMIVJPDXCT-UHFFFAOYSA-N 1 1 346.814 4.421 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC001190393247 1051167154 /nfs/dbraw/zinc/16/71/54/1051167154.db2.gz ZIXBAMIVJPDXCT-UHFFFAOYSA-N 1 1 346.814 4.421 20 5 EIBDMO C[C@H](c1cccnc1)[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000183727249 1051329017 /nfs/dbraw/zinc/32/90/17/1051329017.db2.gz IXXQXIOSAVZAAL-CQSZACIVSA-N 1 1 337.379 4.443 20 5 EIBDMO O=[N+]([O-])c1sc(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)cc1Br ZINC001181860408 1051332054 /nfs/dbraw/zinc/33/20/54/1051332054.db2.gz MWUFYOZDOIBKLX-AOOOYVTPSA-N 1 1 345.262 4.041 20 5 EIBDMO O=[N+]([O-])c1sc(C[N@@H+]2C[C@@H]3CCCC[C@@H]3C2)cc1Br ZINC001181860408 1051332062 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LWKJQKPKVZFUAQ-KGLIPLIRSA-N 1 1 331.441 4.219 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCCC[C@@H]2CC2(O)CCCCC2)c1 ZINC001176061979 1051900303 /nfs/dbraw/zinc/90/03/03/1051900303.db2.gz MGBHSMCGXVFHOY-GOSISDBHSA-N 1 1 332.444 4.035 20 5 EIBDMO CO[C@H](C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC001193744126 1051979528 /nfs/dbraw/zinc/97/95/28/1051979528.db2.gz ZUWCPKDKNCPXNW-GOSISDBHSA-N 1 1 348.830 4.110 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](Cc2nccs2)C1 ZINC001184264507 1051980632 /nfs/dbraw/zinc/98/06/32/1051980632.db2.gz DPKHMSBLYXLXBW-SCZPIIQISA-N 1 1 343.452 4.019 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCc2cc(F)cc(C)c2C1 ZINC001193773621 1051986231 /nfs/dbraw/zinc/98/62/31/1051986231.db2.gz TXLUJJINCBJBCR-CQSZACIVSA-N 1 1 328.387 4.470 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCc2cc(F)cc(C)c2C1 ZINC001193773621 1051986236 /nfs/dbraw/zinc/98/62/36/1051986236.db2.gz TXLUJJINCBJBCR-CQSZACIVSA-N 1 1 328.387 4.470 20 5 EIBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+](CCc2ccccc2)C2CC2)cc1 ZINC001176410957 1052064738 /nfs/dbraw/zinc/06/47/38/1052064738.db2.gz FDIYTMHMQMLLMR-UHFFFAOYSA-N 1 1 340.423 4.071 20 5 EIBDMO CCCC[N@H+]1CCCC[C@@H]1CNc1ccc(Cl)cc1[N+](=O)[O-] ZINC001185099052 1052167875 /nfs/dbraw/zinc/16/78/75/1052167875.db2.gz WJVIHGHMGAKBSL-CQSZACIVSA-N 1 1 325.840 4.315 20 5 EIBDMO CC(C)[C@H](c1ccccc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774889337 1052250601 /nfs/dbraw/zinc/25/06/01/1052250601.db2.gz ZEQKZKVXFGTTBD-GOSISDBHSA-N 1 1 343.383 4.332 20 5 EIBDMO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)s1 ZINC000083174202 1052841978 /nfs/dbraw/zinc/84/19/78/1052841978.db2.gz UKTXBIYKTWZWCS-AWEZNQCLSA-N 1 1 343.408 4.443 20 5 EIBDMO Cc1ccc([C@@H]2CCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)s1 ZINC000083174202 1052841980 /nfs/dbraw/zinc/84/19/80/1052841980.db2.gz UKTXBIYKTWZWCS-AWEZNQCLSA-N 1 1 343.408 4.443 20 5 EIBDMO C[N@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1C[C@@H](Oc2ccccc2)C1(C)C ZINC001194881565 1053142464 /nfs/dbraw/zinc/14/24/64/1053142464.db2.gz ALVIRISBXTUKQK-HZPDHXFCSA-N 1 1 346.452 4.334 20 5 EIBDMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1C[C@@H](Oc2ccccc2)C1(C)C ZINC001194881565 1053142483 /nfs/dbraw/zinc/14/24/83/1053142483.db2.gz ALVIRISBXTUKQK-HZPDHXFCSA-N 1 1 346.452 4.334 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@](C)(C(=O)OC(C)(C)C)C1 ZINC001194905790 1053157085 /nfs/dbraw/zinc/15/70/85/1053157085.db2.gz LMFZVMJKNUAVPP-LIRRHRJNSA-N 1 1 348.443 4.018 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)c1 ZINC001195298977 1053368631 /nfs/dbraw/zinc/36/86/31/1053368631.db2.gz KGGHWLNXSOSKJT-SNVBAGLBSA-N 1 1 336.741 4.413 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)c1 ZINC001195298977 1053368647 /nfs/dbraw/zinc/36/86/47/1053368647.db2.gz KGGHWLNXSOSKJT-SNVBAGLBSA-N 1 1 336.741 4.413 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3cccnc3)C2)c(Cl)c1 ZINC001195546248 1053431921 /nfs/dbraw/zinc/43/19/21/1053431921.db2.gz AGIXXFDRRYFGMC-CQSZACIVSA-N 1 1 331.803 4.023 20 5 EIBDMO C[C@]1(c2cccc(F)c2)CC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC001195842561 1053503095 /nfs/dbraw/zinc/50/30/95/1053503095.db2.gz GGLNKUBLQKGXIO-SFHVURJKSA-N 1 1 332.350 4.037 20 5 EIBDMO C[C@]1(c2cccc(F)c2)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC001195842561 1053503107 /nfs/dbraw/zinc/50/31/07/1053503107.db2.gz GGLNKUBLQKGXIO-SFHVURJKSA-N 1 1 332.350 4.037 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](N(C)c2ccccc2)C1 ZINC001196505719 1053687036 /nfs/dbraw/zinc/68/70/36/1053687036.db2.gz FRAZSLIGWCYGGP-QFBILLFUSA-N 1 1 339.439 4.175 20 5 EIBDMO Cc1ccc(C[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)cc1[N+](=O)[O-] ZINC000866539800 1053774107 /nfs/dbraw/zinc/77/41/07/1053774107.db2.gz GZQRMPXCUDFJFN-KRWDZBQOSA-N 1 1 328.416 4.038 20 5 EIBDMO Cn1ccnc1[C@H]([NH2+]CCCCC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000552249642 1053842362 /nfs/dbraw/zinc/84/23/62/1053842362.db2.gz GSBBNIZMMWZQSG-QGZVFWFLSA-N 1 1 344.459 4.224 20 5 EIBDMO CC(C)c1cc([C@H]2CCC[N@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])C2)[nH]n1 ZINC001197542353 1053933821 /nfs/dbraw/zinc/93/38/21/1053933821.db2.gz KQKADVBJKJEQIZ-GJZGRUSLSA-N 1 1 342.443 4.382 20 5 EIBDMO CC(C)c1cc([C@H]2CCC[N@@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])C2)n[nH]1 ZINC001197542353 1053933836 /nfs/dbraw/zinc/93/38/36/1053933836.db2.gz KQKADVBJKJEQIZ-GJZGRUSLSA-N 1 1 342.443 4.382 20 5 EIBDMO CC(C)c1cc([C@H]2CCC[N@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])C2)n[nH]1 ZINC001197542353 1053933852 /nfs/dbraw/zinc/93/38/52/1053933852.db2.gz KQKADVBJKJEQIZ-GJZGRUSLSA-N 1 1 342.443 4.382 20 5 EIBDMO CC[C@@H](C[N@@H+](CC)C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000775895885 1054281106 /nfs/dbraw/zinc/28/11/06/1054281106.db2.gz OYWFMUPHHUHFPD-OXJNMPFZSA-N 1 1 342.439 4.144 20 5 EIBDMO C[C@@H]([NH2+]C1(c2c(F)cccc2F)CCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000858605650 1054534203 /nfs/dbraw/zinc/53/42/03/1054534203.db2.gz YCYSRIHBYFSFJC-LLVKDONJSA-N 1 1 347.365 4.185 20 5 EIBDMO Cc1cccc(C)c1C[NH2+]Cc1c(Br)cccc1[N+](=O)[O-] ZINC001201609907 1054863834 /nfs/dbraw/zinc/86/38/34/1054863834.db2.gz ZODPTKZVOYYQFZ-UHFFFAOYSA-N 1 1 349.228 4.264 20 5 EIBDMO COc1cc(F)c([C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000173416690 1054894902 /nfs/dbraw/zinc/89/49/02/1054894902.db2.gz HUYYMZJCGIKCPN-RYUDHWBXSA-N 1 1 348.374 4.163 20 5 EIBDMO COc1cc(F)c([C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000173416713 1054895316 /nfs/dbraw/zinc/89/53/16/1054895316.db2.gz HUYYMZJCGIKCPN-NWDGAFQWSA-N 1 1 348.374 4.163 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)cc1 ZINC000776276631 1055143984 /nfs/dbraw/zinc/14/39/84/1055143984.db2.gz LIDZCJWAZIPJGW-ROUUACIJSA-N 1 1 346.814 4.119 20 5 EIBDMO Cc1ccc([C@@H]2CCC[N@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1C ZINC000776279943 1055150573 /nfs/dbraw/zinc/15/05/73/1055150573.db2.gz VDWYEIWJNPKUAS-VQTJNVASSA-N 1 1 340.423 4.082 20 5 EIBDMO CC[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CCCC[C@H]1C ZINC000878474786 1055320905 /nfs/dbraw/zinc/32/09/05/1055320905.db2.gz FMQOIDIXOVZRKL-HIFRSBDPSA-N 1 1 344.415 4.045 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1NC[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000301484946 1055633890 /nfs/dbraw/zinc/63/38/90/1055633890.db2.gz WCARNSIOQNZZFF-KBXCAEBGSA-N 1 1 345.468 4.460 20 5 EIBDMO C[C@H]([NH2+]Cc1cscc1Br)c1cccc([N+](=O)[O-])c1 ZINC000387974829 1056130585 /nfs/dbraw/zinc/13/05/85/1056130585.db2.gz DCLHPRVOWUNJQN-VIFPVBQESA-N 1 1 341.230 4.270 20 5 EIBDMO CC[C@@H](O)C[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542928028 1056777228 /nfs/dbraw/zinc/77/72/28/1056777228.db2.gz OODVPLXQRIMEJI-QGZVFWFLSA-N 1 1 348.830 4.021 20 5 EIBDMO CC[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542928028 1056777240 /nfs/dbraw/zinc/77/72/40/1056777240.db2.gz OODVPLXQRIMEJI-QGZVFWFLSA-N 1 1 348.830 4.021 20 5 EIBDMO CC[N@@H+](Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])[C@@H](C)C(C)C ZINC000065299414 1058200043 /nfs/dbraw/zinc/20/00/43/1058200043.db2.gz WZWYFNCNMFMCQG-NSHDSACASA-N 1 1 346.374 4.071 20 5 EIBDMO Cc1nn(C[N@@H+]2CCCC[C@@H]2c2cccc(C)c2C)c(C)c1[N+](=O)[O-] ZINC000743386926 1058968715 /nfs/dbraw/zinc/96/87/15/1058968715.db2.gz BEDCESQIEYFECP-GOSISDBHSA-N 1 1 342.443 4.210 20 5 EIBDMO Cc1nn(C[N@H+]2CCCC[C@@H]2c2cccc(C)c2C)c(C)c1[N+](=O)[O-] ZINC000743386926 1058968741 /nfs/dbraw/zinc/96/87/41/1058968741.db2.gz BEDCESQIEYFECP-GOSISDBHSA-N 1 1 342.443 4.210 20 5 EIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@@H](CSc2ccccc2)C1 ZINC000743859983 1059166872 /nfs/dbraw/zinc/16/68/72/1059166872.db2.gz NAULGHJZQVZVJN-CQSZACIVSA-N 1 1 346.427 4.348 20 5 EIBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@H](c3ccc(Cl)c(Cl)c3)C2)C1 ZINC001169036395 1060595455 /nfs/dbraw/zinc/59/54/55/1060595455.db2.gz OANHWEMVBLKEPF-XBFCOCLRSA-N 1 1 343.254 4.228 20 5 EIBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC001169048363 1060603230 /nfs/dbraw/zinc/60/32/30/1060603230.db2.gz UWFKAZCZFNCUJF-DAXOMENPSA-N 1 1 342.361 4.288 20 5 EIBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC001169048364 1060603625 /nfs/dbraw/zinc/60/36/25/1060603625.db2.gz UWFKAZCZFNCUJF-KCXAZCMYSA-N 1 1 342.361 4.288 20 5 EIBDMO C[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC001169282476 1060740999 /nfs/dbraw/zinc/74/09/99/1060740999.db2.gz DFOWQIDSPKFLLZ-BXUZGUMPSA-N 1 1 341.249 4.368 20 5 EIBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCCC3(CCCCC3)CC2)c1 ZINC001169306811 1060766607 /nfs/dbraw/zinc/76/66/07/1060766607.db2.gz JIXRKMYQYBDPBC-GOSISDBHSA-N 1 1 332.444 4.065 20 5 EIBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCCCC[C@H]1/C=C\c1ccccc1 ZINC001168144165 1032209191 /nfs/dbraw/zinc/20/91/91/1032209191.db2.gz BYJPRQZWGTYQCZ-HSNDNRACSA-N 1 1 337.423 4.448 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1ccc2ccccc2c1 ZINC000015306353 1032750939 /nfs/dbraw/zinc/75/09/39/1032750939.db2.gz AJUVCYNBDKWKIU-UHFFFAOYSA-N 1 1 336.391 4.389 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1ccc2ccccc2c1 ZINC000015306353 1032750958 /nfs/dbraw/zinc/75/09/58/1032750958.db2.gz AJUVCYNBDKWKIU-UHFFFAOYSA-N 1 1 336.391 4.389 20 5 EIBDMO CC[N@@H+](Cc1c[nH]c2ccccc12)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430196253 1019185557 /nfs/dbraw/zinc/18/55/57/1019185557.db2.gz QUZMWNXGIAFEDQ-UHFFFAOYSA-N 1 1 339.395 4.107 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)c1ccc(F)cc1Cl ZINC000430201002 1019253242 /nfs/dbraw/zinc/25/32/42/1019253242.db2.gz BLQSQLWQZOGSDA-SNVBAGLBSA-N 1 1 338.766 4.247 20 5 EIBDMO O=[N+]([O-])c1ccc(OC(F)F)c(CNc2ccc(C3CCC3)c[nH+]2)c1 ZINC000339566581 1019392393 /nfs/dbraw/zinc/39/23/93/1019392393.db2.gz ZODSMKLZPAALNM-UHFFFAOYSA-N 1 1 349.337 4.471 20 5 EIBDMO Cc1[nH+]ccn1CCCCNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000339678089 1019798388 /nfs/dbraw/zinc/79/83/88/1019798388.db2.gz QULRYKJSCXICSC-UHFFFAOYSA-N 1 1 342.321 4.011 20 5 EIBDMO CC[C@H]1CCCC[C@H]1[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000120729888 1020105893 /nfs/dbraw/zinc/10/58/93/1020105893.db2.gz BMAZQIHIYWDVKD-XJKSGUPXSA-N 1 1 344.415 4.045 20 5 EIBDMO C[C@H]1CCC[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001167226694 1020603468 /nfs/dbraw/zinc/60/34/68/1020603468.db2.gz AAHQJXVDCNQILB-AAEUAGOBSA-N 1 1 341.249 4.368 20 5 EIBDMO CCCC[N@H+](Cc1ccccc1F)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001167293801 1020897293 /nfs/dbraw/zinc/89/72/93/1020897293.db2.gz AQIYZFPLJKYNHU-IBGZPJMESA-N 1 1 346.402 4.070 20 5 EIBDMO O=[N+]([O-])c1cc(Nc2ccc(CC[NH+]3CCCCC3)cc2)ccc1O ZINC001210399254 1021072583 /nfs/dbraw/zinc/07/25/83/1021072583.db2.gz OSRXSJTYVHFPOX-UHFFFAOYSA-N 1 1 341.411 4.072 20 5 EIBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H]2COc3ccc(C)cc32)cc1[N+](=O)[O-] ZINC000090452409 1021269810 /nfs/dbraw/zinc/26/98/10/1021269810.db2.gz MGKAXEOAZJRPAL-CZUORRHYSA-N 1 1 342.395 4.086 20 5 EIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cnc(C2CCCC2)s1 ZINC000584497131 1021320223 /nfs/dbraw/zinc/32/02/23/1021320223.db2.gz KFNKEKKXVVMZMD-UHFFFAOYSA-N 1 1 345.468 4.383 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCS[C@H](c2ccccc2)C1 ZINC000610369754 1021551648 /nfs/dbraw/zinc/55/16/48/1021551648.db2.gz SSJYTLQQDMOKQJ-KDOFPFPSSA-N 1 1 328.437 4.446 20 5 EIBDMO Cn1cc(C[N@@H+]2CCCCC[C@H]2c2ccc(Cl)cc2)c([N+](=O)[O-])n1 ZINC001167406006 1022064348 /nfs/dbraw/zinc/06/43/48/1022064348.db2.gz MGUHQUCKZCLFND-INIZCTEOSA-N 1 1 348.834 4.099 20 5 EIBDMO Cn1cc(C[N@H+]2CCCCC[C@H]2c2ccc(Cl)cc2)c([N+](=O)[O-])n1 ZINC001167406006 1022064363 /nfs/dbraw/zinc/06/43/63/1022064363.db2.gz MGUHQUCKZCLFND-INIZCTEOSA-N 1 1 348.834 4.099 20 5 EIBDMO Cc1c([C@@H](C)[NH2+]Cc2csc(-c3ccco3)n2)cccc1[N+](=O)[O-] ZINC000128427570 1022399256 /nfs/dbraw/zinc/39/92/56/1022399256.db2.gz BOJUAAAMWCDSCC-GFCCVEGCSA-N 1 1 343.408 4.471 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+]Cc2ccc(Br)o2)cc1[N+](=O)[O-] ZINC000188734840 1022809594 /nfs/dbraw/zinc/80/95/94/1022809594.db2.gz UJIYFSXXVCMUJU-JTQLQIEISA-N 1 1 339.189 4.110 20 5 EIBDMO CCc1nc2c(s1)[C@H]([N@H+](C)Cc1cc(F)ccc1[N+](=O)[O-])CCC2 ZINC000177898782 1022817325 /nfs/dbraw/zinc/81/73/25/1022817325.db2.gz SFTGKEQIFGINKN-OAHLLOKOSA-N 1 1 349.431 4.262 20 5 EIBDMO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-])CCC2 ZINC000177898782 1022817326 /nfs/dbraw/zinc/81/73/26/1022817326.db2.gz SFTGKEQIFGINKN-OAHLLOKOSA-N 1 1 349.431 4.262 20 5 EIBDMO CC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)[C@H](C)C(C)C ZINC000120269423 1023148497 /nfs/dbraw/zinc/14/84/97/1023148497.db2.gz HCVRLCZUHVMHEK-CQSZACIVSA-N 1 1 331.416 4.159 20 5 EIBDMO CC(C)(C)c1ccncc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000414501786 1023250525 /nfs/dbraw/zinc/25/05/25/1023250525.db2.gz SSUIOEKAAUJRNG-UHFFFAOYSA-N 1 1 333.819 4.231 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC3(CCCC3)C2)ccc1Br ZINC000312487596 1023324248 /nfs/dbraw/zinc/32/42/48/1023324248.db2.gz INVXXBNDFMNOTH-UHFFFAOYSA-N 1 1 339.233 4.123 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC3(CCCC3)C2)ccc1Br ZINC000312487596 1023324252 /nfs/dbraw/zinc/32/42/52/1023324252.db2.gz INVXXBNDFMNOTH-UHFFFAOYSA-N 1 1 339.233 4.123 20 5 EIBDMO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)s1 ZINC000276342425 1023336845 /nfs/dbraw/zinc/33/68/45/1023336845.db2.gz UGWWWZVQFCJBQN-LLVKDONJSA-N 1 1 337.420 4.254 20 5 EIBDMO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)s1 ZINC000276342425 1023336848 /nfs/dbraw/zinc/33/68/48/1023336848.db2.gz UGWWWZVQFCJBQN-LLVKDONJSA-N 1 1 337.420 4.254 20 5 EIBDMO CCOC[C@@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000126578155 1023371939 /nfs/dbraw/zinc/37/19/39/1023371939.db2.gz YSLJMXJIWXOLGV-OAHLLOKOSA-N 1 1 344.411 4.103 20 5 EIBDMO C[C@H]1C[C@@]1([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc(Cl)cc1 ZINC000500395339 1023785206 /nfs/dbraw/zinc/78/52/06/1023785206.db2.gz GUEVSYMQQOCZEI-GTNSWQLSSA-N 1 1 334.778 4.412 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@@H]4CCC[C@H]43)cs2)c1 ZINC000511844094 1023932328 /nfs/dbraw/zinc/93/23/28/1023932328.db2.gz PLBDGVYXIGDJRZ-SUMWQHHRSA-N 1 1 343.452 4.483 20 5 EIBDMO C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])s2)CC[N@H+]1Cc1ccccc1 ZINC000610573516 1023946330 /nfs/dbraw/zinc/94/63/30/1023946330.db2.gz NVHGEZBRZXKCPC-HIFRSBDPSA-N 1 1 331.441 4.121 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[NH2+]C3(c4ccc(F)cc4)CCC3)nc2c1 ZINC000610581337 1024116713 /nfs/dbraw/zinc/11/67/13/1024116713.db2.gz BELCPBRYWXMPRE-UHFFFAOYSA-N 1 1 341.342 4.044 20 5 EIBDMO CC[C@H]1c2ccccc2CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581692 1024130230 /nfs/dbraw/zinc/13/02/30/1024130230.db2.gz AEIHWERNCAHBLE-KRWDZBQOSA-N 1 1 337.379 4.245 20 5 EIBDMO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581692 1024130243 /nfs/dbraw/zinc/13/02/43/1024130243.db2.gz AEIHWERNCAHBLE-KRWDZBQOSA-N 1 1 337.379 4.245 20 5 EIBDMO C[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)[C@H]2CCCC[C@@H]12 ZINC000610581893 1024131913 /nfs/dbraw/zinc/13/19/13/1024131913.db2.gz XNMCFCNGYKLFRP-INWMFGNUSA-N 1 1 329.400 4.137 20 5 EIBDMO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581693 1024133664 /nfs/dbraw/zinc/13/36/64/1024133664.db2.gz AEIHWERNCAHBLE-QGZVFWFLSA-N 1 1 337.379 4.245 20 5 EIBDMO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581693 1024133687 /nfs/dbraw/zinc/13/36/87/1024133687.db2.gz AEIHWERNCAHBLE-QGZVFWFLSA-N 1 1 337.379 4.245 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCO[C@@H]3CCC[C@H]32)s1 ZINC000510685116 1024232798 /nfs/dbraw/zinc/23/27/98/1024232798.db2.gz UCGRGWOYENGMPK-IAGOWNOFSA-N 1 1 344.436 4.077 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCO[C@@H]3CCC[C@H]32)s1 ZINC000510685116 1024232823 /nfs/dbraw/zinc/23/28/23/1024232823.db2.gz UCGRGWOYENGMPK-IAGOWNOFSA-N 1 1 344.436 4.077 20 5 EIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cccc(-c2ccncc2)c1 ZINC000549808843 1033223035 /nfs/dbraw/zinc/22/30/35/1033223035.db2.gz YAGYWKGAZWVKPK-UHFFFAOYSA-N 1 1 347.418 4.331 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@H](C)O[C@@H](c2ccc(F)cc2)C1 ZINC000544607875 1024831196 /nfs/dbraw/zinc/83/11/96/1024831196.db2.gz LJTNQIBWFAHCKG-IFXJQAMLSA-N 1 1 344.386 4.004 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@H](C)O[C@@H](c2ccc(F)cc2)C1 ZINC000544607875 1024831197 /nfs/dbraw/zinc/83/11/97/1024831197.db2.gz LJTNQIBWFAHCKG-IFXJQAMLSA-N 1 1 344.386 4.004 20 5 EIBDMO COc1cccc(Cl)c1C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000091062050 1024831776 /nfs/dbraw/zinc/83/17/76/1024831776.db2.gz DCKXXUMXOROCJA-GFCCVEGCSA-N 1 1 334.803 4.416 20 5 EIBDMO CC[C@@H]([NH2+][C@H]1COc2c1cccc2Cl)c1cccc([N+](=O)[O-])c1 ZINC000610831154 1025051798 /nfs/dbraw/zinc/05/17/98/1025051798.db2.gz DCOSUTXMQOZTAI-CVEARBPZSA-N 1 1 332.787 4.423 20 5 EIBDMO C[C@H]([NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccncc1F ZINC000511034261 1025765865 /nfs/dbraw/zinc/76/58/65/1025765865.db2.gz QXCJRWYOILFQNH-APPDUMDISA-N 1 1 329.375 4.202 20 5 EIBDMO C[C@@H]1CCC[N@@H+](Cc2ccccc2CNc2ccc([N+](=O)[O-])cc2)C1 ZINC000071954809 1025870534 /nfs/dbraw/zinc/87/05/34/1025870534.db2.gz UCPSXNODCWPJAF-MRXNPFEDSA-N 1 1 339.439 4.439 20 5 EIBDMO CC1(C)C[C@@H]([NH2+]Cc2ccc(Cl)cn2)c2cc([N+](=O)[O-])ccc21 ZINC000279036653 1025994907 /nfs/dbraw/zinc/99/49/07/1025994907.db2.gz JAYUHGWAFLXADG-MRXNPFEDSA-N 1 1 331.803 4.155 20 5 EIBDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)C12CCCCC2 ZINC001167538882 1025999009 /nfs/dbraw/zinc/99/90/09/1025999009.db2.gz FZFMBAHHQMXZNR-RBUKOAKNSA-N 1 1 346.471 4.463 20 5 EIBDMO COc1cc(C[NH2+][C@H](C)c2ccc(F)c(C)c2)c([N+](=O)[O-])cc1F ZINC000274358034 1026011640 /nfs/dbraw/zinc/01/16/40/1026011640.db2.gz YWDWLHHNSSSNII-LLVKDONJSA-N 1 1 336.338 4.041 20 5 EIBDMO CCCC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C1CCCCC1 ZINC000550159560 1026245600 /nfs/dbraw/zinc/24/56/00/1026245600.db2.gz RYXZBHJUGPGPCX-UHFFFAOYSA-N 1 1 347.459 4.277 20 5 EIBDMO Cc1cc(N[C@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000507001914 1026573118 /nfs/dbraw/zinc/57/31/18/1026573118.db2.gz MCRDMYKZWBJURT-YJBOKZPZSA-N 1 1 325.412 4.151 20 5 EIBDMO COc1ccc2c(c1)CCC[C@@H]2[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000507139538 1026658552 /nfs/dbraw/zinc/65/85/52/1026658552.db2.gz BYXRDXQNHWIJHM-INIZCTEOSA-N 1 1 332.425 4.174 20 5 EIBDMO COc1ccc2c(c1)CCC[C@@H]2[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000507139538 1026658555 /nfs/dbraw/zinc/65/85/55/1026658555.db2.gz BYXRDXQNHWIJHM-INIZCTEOSA-N 1 1 332.425 4.174 20 5 EIBDMO CCOc1ccccc1C1=CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000479566657 1026841580 /nfs/dbraw/zinc/84/15/80/1026841580.db2.gz MBKDNWUGZKPAEN-UHFFFAOYSA-N 1 1 338.407 4.283 20 5 EIBDMO C[N@@H+](CCC1CCCCC1)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000507634762 1026860483 /nfs/dbraw/zinc/86/04/83/1026860483.db2.gz OKZBQSVNWIMXJI-UHFFFAOYSA-N 1 1 344.415 4.047 20 5 EIBDMO CC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)[C@H](C)c1cccc(OC)c1 ZINC000507700781 1026878822 /nfs/dbraw/zinc/87/88/22/1026878822.db2.gz MFISUHUSFFNDQI-OAHLLOKOSA-N 1 1 344.411 4.065 20 5 EIBDMO CC(C)CCOC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000543858094 1026905412 /nfs/dbraw/zinc/90/54/12/1026905412.db2.gz ONMBHUZMFGHBLI-UHFFFAOYSA-N 1 1 340.851 4.275 20 5 EIBDMO C[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccs1 ZINC000078338438 1027323302 /nfs/dbraw/zinc/32/33/02/1027323302.db2.gz PSGMHJWUWKUZMX-SUMWQHHRSA-N 1 1 331.441 4.151 20 5 EIBDMO CCC[N@@H+](CC)Cc1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000508483404 1027370351 /nfs/dbraw/zinc/37/03/51/1027370351.db2.gz GTQAIWQSSKAQLU-UHFFFAOYSA-N 1 1 341.411 4.079 20 5 EIBDMO CCSc1cccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)c1 ZINC000185516737 1027437272 /nfs/dbraw/zinc/43/72/72/1027437272.db2.gz RTRBNSAMSANYBR-UHFFFAOYSA-N 1 1 332.425 4.005 20 5 EIBDMO CC[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)CC1CCC1 ZINC000475576603 1027694991 /nfs/dbraw/zinc/69/49/91/1027694991.db2.gz AFEJVHRIDMERCM-UHFFFAOYSA-N 1 1 331.441 4.340 20 5 EIBDMO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H](C)c1ccc(F)cc1 ZINC000444580258 1027883836 /nfs/dbraw/zinc/88/38/36/1027883836.db2.gz CCLKCQVNPYTWQU-LBPRGKRZSA-N 1 1 342.374 4.193 20 5 EIBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H](C)c1ccc(F)cc1 ZINC000444580258 1027883838 /nfs/dbraw/zinc/88/38/38/1027883838.db2.gz CCLKCQVNPYTWQU-LBPRGKRZSA-N 1 1 342.374 4.193 20 5 EIBDMO CC[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000444675373 1027958317 /nfs/dbraw/zinc/95/83/17/1027958317.db2.gz LWGOMLJRJCYQEH-BBRMVZONSA-N 1 1 344.415 4.045 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000444712961 1028004001 /nfs/dbraw/zinc/00/40/01/1028004001.db2.gz XNEVFMDXYDBEAV-GFCCVEGCSA-N 1 1 346.349 4.156 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000444712961 1028004024 /nfs/dbraw/zinc/00/40/24/1028004024.db2.gz XNEVFMDXYDBEAV-GFCCVEGCSA-N 1 1 346.349 4.156 20 5 EIBDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2csc([N+](=O)[O-])c2)C12CCCCC2 ZINC000525126728 1029466905 /nfs/dbraw/zinc/46/69/05/1029466905.db2.gz LHFNUHIWYVMVNG-GJZGRUSLSA-N 1 1 338.473 4.216 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@@H](CSc3ccccc3)C2)c1 ZINC000525267527 1029552977 /nfs/dbraw/zinc/55/29/77/1029552977.db2.gz USRMJNGRVAPZNN-MRXNPFEDSA-N 1 1 328.437 4.209 20 5 EIBDMO C[C@]1(O)CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000475334059 1029562404 /nfs/dbraw/zinc/56/24/04/1029562404.db2.gz USFATZJLYCRUJB-SFHVURJKSA-N 1 1 346.452 4.060 20 5 EIBDMO C[C@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000026475243 1030310774 /nfs/dbraw/zinc/31/07/74/1030310774.db2.gz VKBCPEYSBFCXMJ-MGPUTAFESA-N 1 1 333.391 4.430 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@H]3CCC3CCCC3)nc2c1 ZINC001168176724 1030747948 /nfs/dbraw/zinc/74/79/48/1030747948.db2.gz YEMNTAHVNPBJKS-HNNXBMFYSA-N 1 1 342.443 4.406 20 5 EIBDMO C[N@@H+](Cc1cccc(-c2cccnc2)c1)Cc1ccccc1[N+](=O)[O-] ZINC000179315583 1030898544 /nfs/dbraw/zinc/89/85/44/1030898544.db2.gz OBBXGMKUFWHUJD-UHFFFAOYSA-N 1 1 333.391 4.289 20 5 EIBDMO COc1cccc(Cl)c1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000188470748 1031222761 /nfs/dbraw/zinc/22/27/61/1031222761.db2.gz KYQSKZCSPBPNFR-LBPRGKRZSA-N 1 1 334.803 4.416 20 5 EIBDMO CCOc1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C(C)C)cc1 ZINC000520173721 1031325652 /nfs/dbraw/zinc/32/56/52/1031325652.db2.gz YCIPFUSCPUNNOU-UHFFFAOYSA-N 1 1 328.412 4.404 20 5 EIBDMO COCCCCc1ccc[nH+]c1N[C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449336965 1031655505 /nfs/dbraw/zinc/65/55/05/1031655505.db2.gz PXQWZEFILDLUOO-HNNXBMFYSA-N 1 1 343.427 4.002 20 5 EIBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1(C)C ZINC000449503363 1031812097 /nfs/dbraw/zinc/81/20/97/1031812097.db2.gz TYHOYZMYRSATGK-SFHVURJKSA-N 1 1 344.411 4.102 20 5 EIBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1(C)C ZINC000449506983 1031813655 /nfs/dbraw/zinc/81/36/55/1031813655.db2.gz ZXSGDYVUDMUZNV-GOSISDBHSA-N 1 1 344.411 4.102 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](CC(=O)OC(C)(C)C)C1 ZINC000532124863 1032053228 /nfs/dbraw/zinc/05/32/28/1032053228.db2.gz KEFIRLAXHQPQCY-LSDHHAIUSA-N 1 1 348.443 4.100 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](CC(=O)OC(C)(C)C)C1 ZINC000532127307 1032053635 /nfs/dbraw/zinc/05/36/35/1032053635.db2.gz RYFAFPJRDBJDHZ-LSDHHAIUSA-N 1 1 348.443 4.100 20 5 EIBDMO Cc1csc([C@H](C)[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)n1 ZINC000433169663 1033974953 /nfs/dbraw/zinc/97/49/53/1033974953.db2.gz YBOMYEYUXVCOSC-XHDPSFHLSA-N 1 1 331.441 4.433 20 5 EIBDMO C[C@H]1C[C@@H]1c1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)o1 ZINC000030153145 1034640947 /nfs/dbraw/zinc/64/09/47/1034640947.db2.gz QHEUAUYDGBOIMK-UGSOOPFHSA-N 1 1 326.396 4.476 20 5 EIBDMO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)o1 ZINC000030153145 1034640960 /nfs/dbraw/zinc/64/09/60/1034640960.db2.gz QHEUAUYDGBOIMK-UGSOOPFHSA-N 1 1 326.396 4.476 20 5 EIBDMO C[C@@H]1C[C@@H](c2ccccc2)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000513235861 1034851840 /nfs/dbraw/zinc/85/18/40/1034851840.db2.gz GFUTXUNPUANJQK-ACJLOTCBSA-N 1 1 336.395 4.054 20 5 EIBDMO C[C@@H]1C[C@@H](c2ccccc2)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000513235861 1034851846 /nfs/dbraw/zinc/85/18/46/1034851846.db2.gz GFUTXUNPUANJQK-ACJLOTCBSA-N 1 1 336.395 4.054 20 5 EIBDMO CC[C@H](N[C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000183195531 1035338136 /nfs/dbraw/zinc/33/81/36/1035338136.db2.gz IGYKZUOQMAWHLY-MDYRTPRTSA-N 1 1 345.487 4.289 20 5 EIBDMO CC[C@H](N[C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000183195531 1035338143 /nfs/dbraw/zinc/33/81/43/1035338143.db2.gz IGYKZUOQMAWHLY-MDYRTPRTSA-N 1 1 345.487 4.289 20 5 EIBDMO CCC[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC)c1ccccn1 ZINC000595015052 1035507101 /nfs/dbraw/zinc/50/71/01/1035507101.db2.gz XQRVCWOUQWZBNO-GUYCJALGSA-N 1 1 329.400 4.190 20 5 EIBDMO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1F ZINC000595002925 1035526151 /nfs/dbraw/zinc/52/61/51/1035526151.db2.gz BQVOTKVWWUHVFC-NEPJUHHUSA-N 1 1 348.374 4.163 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1C[C@@H](C)Oc2ccccc21 ZINC000595041026 1035563934 /nfs/dbraw/zinc/56/39/34/1035563934.db2.gz JFUSPYKOSYMLQG-IIYDPXPESA-N 1 1 342.395 4.166 20 5 EIBDMO C[N@H+](CCOc1ccc2ccccc2c1)Cc1ccccc1[N+](=O)[O-] ZINC000501798380 1035610950 /nfs/dbraw/zinc/61/09/50/1035610950.db2.gz CNKAXKSFQGZIJP-UHFFFAOYSA-N 1 1 336.391 4.259 20 5 EIBDMO C[N@@H+](CCOc1ccc2ccccc2c1)Cc1ccccc1[N+](=O)[O-] ZINC000501798380 1035610969 /nfs/dbraw/zinc/61/09/69/1035610969.db2.gz CNKAXKSFQGZIJP-UHFFFAOYSA-N 1 1 336.391 4.259 20 5 EIBDMO CC[C@H](c1ccccc1)[C@H]1CCC[N@H+]1Cc1onc(C)c1[N+](=O)[O-] ZINC000595297327 1035624386 /nfs/dbraw/zinc/62/43/86/1035624386.db2.gz RHWFDLMKOCGLGP-HZPDHXFCSA-N 1 1 329.400 4.049 20 5 EIBDMO CC[N@@H+](Cc1ccc(OC)c(OC)c1)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000485070024 1035659016 /nfs/dbraw/zinc/65/90/16/1035659016.db2.gz BVTPGLRUOMXCKW-CQSZACIVSA-N 1 1 344.411 4.195 20 5 EIBDMO C[C@@H]([NH2+]Cc1cccc(F)c1OC(F)F)c1ccccc1[N+](=O)[O-] ZINC000595427040 1035675533 /nfs/dbraw/zinc/67/55/33/1035675533.db2.gz WGWINYFZCSWAHC-SNVBAGLBSA-N 1 1 340.301 4.186 20 5 EIBDMO Cc1noc(C[NH2+][C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)c1[N+](=O)[O-] ZINC000595424395 1035676116 /nfs/dbraw/zinc/67/61/16/1035676116.db2.gz MDELOOKHJBMKFV-DYQSUWPFSA-N 1 1 335.791 4.032 20 5 EIBDMO Cc1noc(C[N@H+]2C[C@H](c3ccccc3)[C@@H]3CCCC[C@H]32)c1[N+](=O)[O-] ZINC000595450218 1035683750 /nfs/dbraw/zinc/68/37/50/1035683750.db2.gz SFKNCUZVQMTHAE-GVDBMIGSSA-N 1 1 341.411 4.049 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]([C@H]3CCCCO3)C2)c(Cl)c1 ZINC000595787993 1035794567 /nfs/dbraw/zinc/79/45/67/1035794567.db2.gz LQJIYPMQYUZWGM-RHSMWYFYSA-N 1 1 338.835 4.029 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH+]2CCC3(CCc4ccccc4O3)CC2)cs1 ZINC000595829614 1035800770 /nfs/dbraw/zinc/80/07/70/1035800770.db2.gz WTXYXEPYNSJKPS-UHFFFAOYSA-N 1 1 344.436 4.016 20 5 EIBDMO C[C@H]([NH2+][C@@H]1CCc2ccccc2-n2ccnc21)c1ccc([N+](=O)[O-])cc1 ZINC000596093999 1035821713 /nfs/dbraw/zinc/82/17/13/1035821713.db2.gz FZLRPAXRISVVGU-KBXCAEBGSA-N 1 1 348.406 4.119 20 5 EIBDMO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)s1 ZINC000276342430 1035846996 /nfs/dbraw/zinc/84/69/96/1035846996.db2.gz UGWWWZVQFCJBQN-NSHDSACASA-N 1 1 337.420 4.254 20 5 EIBDMO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)s1 ZINC000276342430 1035846999 /nfs/dbraw/zinc/84/69/99/1035846999.db2.gz UGWWWZVQFCJBQN-NSHDSACASA-N 1 1 337.420 4.254 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](CC(F)F)c1ccccc1 ZINC000420987776 1035899364 /nfs/dbraw/zinc/89/93/64/1035899364.db2.gz RDRMJFMZEFHQOZ-HNNXBMFYSA-N 1 1 336.338 4.090 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC(C)(C)[C@H]1c1ccncc1 ZINC000596591209 1035910863 /nfs/dbraw/zinc/91/08/63/1035910863.db2.gz IDPWEQCTWLZRHD-KBXCAEBGSA-N 1 1 325.412 4.442 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC(C)(C)[C@H]1c1ccncc1 ZINC000596591209 1035910881 /nfs/dbraw/zinc/91/08/81/1035910881.db2.gz IDPWEQCTWLZRHD-KBXCAEBGSA-N 1 1 325.412 4.442 20 5 EIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)CC1CCCCC1 ZINC000044714925 1036010311 /nfs/dbraw/zinc/01/03/11/1036010311.db2.gz WTGOEHGYNNJXKA-CYBMUJFWSA-N 1 1 344.415 4.218 20 5 EIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)CC1CCCCC1 ZINC000044714923 1036011917 /nfs/dbraw/zinc/01/19/17/1036011917.db2.gz WTGOEHGYNNJXKA-ZDUSSCGKSA-N 1 1 344.415 4.218 20 5 EIBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)CC1=CCCOC1 ZINC000597207184 1036153760 /nfs/dbraw/zinc/15/37/60/1036153760.db2.gz YBRQYPRYSJXSGR-UHFFFAOYSA-N 1 1 344.436 4.102 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCCN(c2ccccc2)CC1 ZINC000485745246 1036239293 /nfs/dbraw/zinc/23/92/93/1036239293.db2.gz PDMYGPNNTLXQMT-KRWDZBQOSA-N 1 1 339.439 4.177 20 5 EIBDMO COc1cc(C[N@@H+](Cc2ccc(C)s2)C(C)C)ccc1[N+](=O)[O-] ZINC000485818629 1036302564 /nfs/dbraw/zinc/30/25/64/1036302564.db2.gz SAPUFUPFHQEJPW-UHFFFAOYSA-N 1 1 334.441 4.384 20 5 EIBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCC1(F)F ZINC000588232573 1036305844 /nfs/dbraw/zinc/30/58/44/1036305844.db2.gz OLIGMEQGVKCERD-BXUZGUMPSA-N 1 1 330.400 4.243 20 5 EIBDMO Cc1cscc1C[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602639481 1036548940 /nfs/dbraw/zinc/54/89/40/1036548940.db2.gz JMOUTZCOPLBESG-UHFFFAOYSA-N 1 1 347.259 4.079 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[NH2+][C@@H]3CCCc4c(F)cccc43)nc2c1 ZINC000602671022 1036549006 /nfs/dbraw/zinc/54/90/06/1036549006.db2.gz HDDXIVXIEAEHDF-OAHLLOKOSA-N 1 1 341.342 4.042 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3ccc(C(F)F)nc3)C2)cc1 ZINC000602686487 1036561872 /nfs/dbraw/zinc/56/18/72/1036561872.db2.gz VXHLIIVNFFNVCY-OAHLLOKOSA-N 1 1 347.365 4.307 20 5 EIBDMO CC1(C)C[C@]1([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 ZINC000602715848 1036585672 /nfs/dbraw/zinc/58/56/72/1036585672.db2.gz PFWHXGYUDBURPM-IBGZPJMESA-N 1 1 337.379 4.151 20 5 EIBDMO Cc1cccc2c1CCC[C@@H]2[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602722638 1036590512 /nfs/dbraw/zinc/59/05/12/1036590512.db2.gz PPSBFYANBROGLX-INIZCTEOSA-N 1 1 337.379 4.212 20 5 EIBDMO CSc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)o1 ZINC000603432872 1036839176 /nfs/dbraw/zinc/83/91/76/1036839176.db2.gz VPJOXUBDXZQNPZ-UHFFFAOYSA-N 1 1 346.330 4.218 20 5 EIBDMO CC1(C)C[C@@H]([NH2+]Cc2csc([N+](=O)[O-])c2)c2cc(F)ccc2O1 ZINC000593674347 1036872766 /nfs/dbraw/zinc/87/27/66/1036872766.db2.gz QFFMPOIRRKDZLY-CYBMUJFWSA-N 1 1 336.388 4.187 20 5 EIBDMO CC1(C)C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)c2cc(F)ccc2O1 ZINC000593674302 1036872831 /nfs/dbraw/zinc/87/28/31/1036872831.db2.gz PMAFOOFMUDDMKB-INIZCTEOSA-N 1 1 348.349 4.265 20 5 EIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@H](c3ccco3)C2)c1 ZINC000590160023 1036995669 /nfs/dbraw/zinc/99/56/69/1036995669.db2.gz ZZPCPCGYJPNRHU-NSHDSACASA-N 1 1 340.301 4.196 20 5 EIBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1cccc2ccccc21 ZINC000603850433 1037043920 /nfs/dbraw/zinc/04/39/20/1037043920.db2.gz DELUJESMADYDCT-UHFFFAOYSA-N 1 1 336.391 4.259 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H](c2cc3ccccc3[nH]2)C1 ZINC000603890288 1037076729 /nfs/dbraw/zinc/07/67/29/1037076729.db2.gz XXKKLFLWLNGSHV-INIZCTEOSA-N 1 1 335.407 4.456 20 5 EIBDMO COc1ccc(CNc2cc[nH+]c3cc(Cl)ccc23)cc1[N+](=O)[O-] ZINC000603932470 1037095887 /nfs/dbraw/zinc/09/58/87/1037095887.db2.gz RGYUXEFTDROVSV-UHFFFAOYSA-N 1 1 343.770 4.417 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@H](C)C2CC2)cc1 ZINC000057601471 1037136181 /nfs/dbraw/zinc/13/61/81/1037136181.db2.gz HUASFFJJQIQFQQ-OAHLLOKOSA-N 1 1 340.423 4.404 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1c1cccc(C)c1 ZINC000604013357 1037151147 /nfs/dbraw/zinc/15/11/47/1037151147.db2.gz CIGXHSLOVGDNJV-GOSISDBHSA-N 1 1 326.396 4.249 20 5 EIBDMO C[N@H+](Cc1cccc([N+](=O)[O-])c1)C[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000604521169 1037404699 /nfs/dbraw/zinc/40/46/99/1037404699.db2.gz AIUASQZZGBFPHP-ICSRJNTNSA-N 1 1 340.423 4.195 20 5 EIBDMO CC1(CC(F)F)C[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000592522410 1038139392 /nfs/dbraw/zinc/13/93/92/1038139392.db2.gz AYTURNCTEGXFQX-UHFFFAOYSA-N 1 1 336.338 4.332 20 5 EIBDMO CC1(CC(F)F)C[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000592523706 1038141911 /nfs/dbraw/zinc/14/19/11/1038141911.db2.gz RJOCEEWZEQCEIF-UHFFFAOYSA-N 1 1 336.338 4.332 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CCOCc1ccccc1 ZINC000490028236 1038310708 /nfs/dbraw/zinc/31/07/08/1038310708.db2.gz GKWLXFNSCVMEHR-MRXNPFEDSA-N 1 1 328.412 4.113 20 5 EIBDMO COc1cc(C[N@@H+]2CC[C@@H](C)C[C@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000490067082 1038330076 /nfs/dbraw/zinc/33/00/76/1038330076.db2.gz LUALNFKOGBVNPF-CJNGLKHVSA-N 1 1 330.384 4.170 20 5 EIBDMO COc1cc(C[N@H+]2CC[C@@H](C)C[C@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000490067082 1038330084 /nfs/dbraw/zinc/33/00/84/1038330084.db2.gz LUALNFKOGBVNPF-CJNGLKHVSA-N 1 1 330.384 4.170 20 5 EIBDMO C[C@H]1C[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)CC(C)(C)C1 ZINC001168423666 1038487937 /nfs/dbraw/zinc/48/79/37/1038487937.db2.gz ONXUHXOJWDZEQU-LLVKDONJSA-N 1 1 341.249 4.225 20 5 EIBDMO C[C@H]1C[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)CC(C)(C)C1 ZINC001168423666 1038488035 /nfs/dbraw/zinc/48/80/35/1038488035.db2.gz ONXUHXOJWDZEQU-LLVKDONJSA-N 1 1 341.249 4.225 20 5 EIBDMO CCC[C@H]([NH2+]Cc1cn2cc(C)ccc2n1)c1cccc([N+](=O)[O-])c1 ZINC000555121300 1038875560 /nfs/dbraw/zinc/87/55/60/1038875560.db2.gz ATAGPZAGKITIPW-SFHVURJKSA-N 1 1 338.411 4.182 20 5 EIBDMO CO[C@H](C)C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)C ZINC000537616288 1038896862 /nfs/dbraw/zinc/89/68/62/1038896862.db2.gz MPLLZWXZTRDDQR-CQSZACIVSA-N 1 1 332.400 4.100 20 5 EIBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@]3(CCCOC3)C2)cc1[N+](=O)[O-] ZINC000537616864 1038910520 /nfs/dbraw/zinc/91/05/20/1038910520.db2.gz YKZJMGVJNGORJL-LJQANCHMSA-N 1 1 332.444 4.111 20 5 EIBDMO C[N@H+]1CC[C@H](Nc2ccc3ncccc3c2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000534270577 1039284586 /nfs/dbraw/zinc/28/45/86/1039284586.db2.gz BFTGSCCJZZWCRJ-RBUKOAKNSA-N 1 1 348.406 4.000 20 5 EIBDMO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1cccc([N+](=O)[O-])c1C)CCC2 ZINC000478052788 1039360149 /nfs/dbraw/zinc/36/01/49/1039360149.db2.gz IBXAPRUPVACBBB-MRXNPFEDSA-N 1 1 345.468 4.432 20 5 EIBDMO COc1ccc(C[N@@H+](C)Cc2cccc(OC(C)C)c2)cc1[N+](=O)[O-] ZINC000534477641 1039484511 /nfs/dbraw/zinc/48/45/11/1039484511.db2.gz KLATZIVYGXSNFV-UHFFFAOYSA-N 1 1 344.411 4.023 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(F)(c2ccccc2)CC1 ZINC000434503812 1039570198 /nfs/dbraw/zinc/57/01/98/1039570198.db2.gz QPJMPRYOBDYAHJ-UHFFFAOYSA-N 1 1 332.350 4.195 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCC12CCCCC2 ZINC000534727683 1039743266 /nfs/dbraw/zinc/74/32/66/1039743266.db2.gz FSXSUYARWIERSU-UHFFFAOYSA-N 1 1 345.443 4.031 20 5 EIBDMO Cc1nc(-c2ccc(C[NH2+]Cc3csc([N+](=O)[O-])c3)cc2)cs1 ZINC000550877806 1039815967 /nfs/dbraw/zinc/81/59/67/1039815967.db2.gz QKMGSKFKYQMZPR-UHFFFAOYSA-N 1 1 345.449 4.378 20 5 EIBDMO C[C@]12CC[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C[C@H]1C2(F)F ZINC000430103486 1039845521 /nfs/dbraw/zinc/84/55/21/1039845521.db2.gz KBKPEJZCNQMCGZ-SJORKVTESA-N 1 1 348.349 4.332 20 5 EIBDMO CCCC[NH+]1CCC([NH2+][C@H](CCC)c2cccc([N+](=O)[O-])c2)CC1 ZINC000325116233 1040061228 /nfs/dbraw/zinc/06/12/28/1040061228.db2.gz NHIPPTVEMRFGHP-LJQANCHMSA-N 1 1 333.476 4.290 20 5 EIBDMO CCCCN1CCC([NH2+][C@H](CCC)c2cccc([N+](=O)[O-])c2)CC1 ZINC000325116233 1040061242 /nfs/dbraw/zinc/06/12/42/1040061242.db2.gz NHIPPTVEMRFGHP-LJQANCHMSA-N 1 1 333.476 4.290 20 5 EIBDMO CCC[C@@H](N[C@H]1CC[N@@H+](C2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000482638612 1040402983 /nfs/dbraw/zinc/40/29/83/1040402983.db2.gz BHPDNUFWTLSHPH-QFBILLFUSA-N 1 1 331.460 4.043 20 5 EIBDMO CCC[C@@H](N[C@H]1CC[N@H+](C2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000482638612 1040402992 /nfs/dbraw/zinc/40/29/92/1040402992.db2.gz BHPDNUFWTLSHPH-QFBILLFUSA-N 1 1 331.460 4.043 20 5 EIBDMO CC[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)Cc1cccs1 ZINC000089882881 1040493390 /nfs/dbraw/zinc/49/33/90/1040493390.db2.gz KYCOFSKJCYVDEU-UHFFFAOYSA-N 1 1 343.408 4.333 20 5 EIBDMO CC[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)Cc1cccs1 ZINC000089882881 1040493398 /nfs/dbraw/zinc/49/33/98/1040493398.db2.gz KYCOFSKJCYVDEU-UHFFFAOYSA-N 1 1 343.408 4.333 20 5 EIBDMO C[C@@H](NC(C)(C)C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000482955522 1040602411 /nfs/dbraw/zinc/60/24/11/1040602411.db2.gz ZZAYZEOSRTVQAB-HZPDHXFCSA-N 1 1 341.455 4.375 20 5 EIBDMO COc1ccc(C[N@@H+]2CC3(CCC3)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000515307206 1040637176 /nfs/dbraw/zinc/63/71/76/1040637176.db2.gz GIRHLJAOZCQDLT-LJQANCHMSA-N 1 1 338.407 4.331 20 5 EIBDMO COc1ccc(C[N@H+]2CC3(CCC3)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000515307206 1040637181 /nfs/dbraw/zinc/63/71/81/1040637181.db2.gz GIRHLJAOZCQDLT-LJQANCHMSA-N 1 1 338.407 4.331 20 5 EIBDMO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1ccc(F)cc1F ZINC000160801883 1040772007 /nfs/dbraw/zinc/77/20/07/1040772007.db2.gz KDECIKZERCZLIS-INIZCTEOSA-N 1 1 336.338 4.123 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000539807241 1040803170 /nfs/dbraw/zinc/80/31/70/1040803170.db2.gz ZGTDWBAKZDITBS-JSGCOSHPSA-N 1 1 346.349 4.008 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000539807241 1040803176 /nfs/dbraw/zinc/80/31/76/1040803176.db2.gz ZGTDWBAKZDITBS-JSGCOSHPSA-N 1 1 346.349 4.008 20 5 EIBDMO C[C@@H]1CCSCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000483425027 1040849895 /nfs/dbraw/zinc/84/98/95/1040849895.db2.gz WXBRKWGFRZWBRA-CYBMUJFWSA-N 1 1 332.425 4.182 20 5 EIBDMO Cc1c([C@H](C)NCCC[N@@H+](C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000480159295 1041016332 /nfs/dbraw/zinc/01/63/32/1041016332.db2.gz LHMYLERCCRGCSV-KRWDZBQOSA-N 1 1 341.455 4.076 20 5 EIBDMO Cc1c([C@H](C)[NH2+]CCCN(C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000480159295 1041016386 /nfs/dbraw/zinc/01/63/86/1041016386.db2.gz LHMYLERCCRGCSV-KRWDZBQOSA-N 1 1 341.455 4.076 20 5 EIBDMO COc1ccc(Cl)cc1C(C)(C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000425517821 1041108873 /nfs/dbraw/zinc/10/88/73/1041108873.db2.gz XFGHBUBAUXJBQL-UHFFFAOYSA-N 1 1 334.803 4.282 20 5 EIBDMO Cc1ccc(C[N@@H+]2CC[C@H](Oc3ccccc3Cl)C2)cc1[N+](=O)[O-] ZINC001168362855 1041247601 /nfs/dbraw/zinc/24/76/01/1041247601.db2.gz SQCLMXKXLNHWMR-HNNXBMFYSA-N 1 1 346.814 4.210 20 5 EIBDMO Cc1ccc(C[N@H+]2CC[C@H](Oc3ccccc3Cl)C2)cc1[N+](=O)[O-] ZINC001168362855 1041247621 /nfs/dbraw/zinc/24/76/21/1041247621.db2.gz SQCLMXKXLNHWMR-HNNXBMFYSA-N 1 1 346.814 4.210 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@H]1CCc1ccccc1 ZINC000505863796 1041419429 /nfs/dbraw/zinc/41/94/29/1041419429.db2.gz HDFAHVZULWMCLA-INIZCTEOSA-N 1 1 328.387 4.331 20 5 EIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cccc(-c2cccnc2)c1 ZINC000554872642 1041464982 /nfs/dbraw/zinc/46/49/82/1041464982.db2.gz BLUREBSGKXEUBH-UHFFFAOYSA-N 1 1 347.418 4.331 20 5 EIBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1cccc(-c3ccncc3)c1)C2 ZINC000538727475 1041495637 /nfs/dbraw/zinc/49/56/37/1041495637.db2.gz TUVWZOLOKMDZJB-UHFFFAOYSA-N 1 1 345.402 4.215 20 5 EIBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1cccc(-c3ccncc3)c1)C2 ZINC000538727475 1041495650 /nfs/dbraw/zinc/49/56/50/1041495650.db2.gz TUVWZOLOKMDZJB-UHFFFAOYSA-N 1 1 345.402 4.215 20 5 EIBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1cccc(-c3cccnc3)c1)C2 ZINC000538728709 1041499334 /nfs/dbraw/zinc/49/93/34/1041499334.db2.gz RNHDPBOCUNUZOD-UHFFFAOYSA-N 1 1 345.402 4.215 20 5 EIBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1cccc(-c3cccnc3)c1)C2 ZINC000538728709 1041499341 /nfs/dbraw/zinc/49/93/41/1041499341.db2.gz RNHDPBOCUNUZOD-UHFFFAOYSA-N 1 1 345.402 4.215 20 5 EIBDMO CC[N@@H+](CCc1nccs1)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000538751295 1041527596 /nfs/dbraw/zinc/52/75/96/1041527596.db2.gz BPYBMSYBPGOZPN-UHFFFAOYSA-N 1 1 333.457 4.239 20 5 EIBDMO CC[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])[C@H]1CCOC(C)(C)C1 ZINC000516352182 1041540792 /nfs/dbraw/zinc/54/07/92/1041540792.db2.gz QCVDWSYIXWFTJK-LBPRGKRZSA-N 1 1 326.824 4.028 20 5 EIBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463456798 1041575114 /nfs/dbraw/zinc/57/51/14/1041575114.db2.gz SYPOJYQVODJNJE-CABCVRRESA-N 1 1 330.350 4.190 20 5 EIBDMO COc1cc(C[N@H+](C)[C@H](C)c2ccc(C)cc2)c([N+](=O)[O-])cc1F ZINC000463493779 1041589470 /nfs/dbraw/zinc/58/94/70/1041589470.db2.gz YSBQCLZSFPJSAC-CYBMUJFWSA-N 1 1 332.375 4.244 20 5 EIBDMO COc1cc(C[N@@H+](C)[C@H](C)c2ccc(C)cc2)c([N+](=O)[O-])cc1F ZINC000463493779 1041589477 /nfs/dbraw/zinc/58/94/77/1041589477.db2.gz YSBQCLZSFPJSAC-CYBMUJFWSA-N 1 1 332.375 4.244 20 5 EIBDMO COc1cc(C[N@H+](Cc2cccs2)C(C)C)c([N+](=O)[O-])cc1F ZINC000463484438 1041592884 /nfs/dbraw/zinc/59/28/84/1041592884.db2.gz RISFHFLKKRTICX-UHFFFAOYSA-N 1 1 338.404 4.215 20 5 EIBDMO COc1cc(C[N@@H+](Cc2cccs2)C(C)C)c([N+](=O)[O-])cc1F ZINC000463484438 1041592889 /nfs/dbraw/zinc/59/28/89/1041592889.db2.gz RISFHFLKKRTICX-UHFFFAOYSA-N 1 1 338.404 4.215 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@@H](c2ccccn2)C1 ZINC000595503231 1041763784 /nfs/dbraw/zinc/76/37/84/1041763784.db2.gz YVFRCHSYWVQQLH-CYBMUJFWSA-N 1 1 331.803 4.023 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H](c2ccccn2)C1 ZINC000595503231 1041763790 /nfs/dbraw/zinc/76/37/90/1041763790.db2.gz YVFRCHSYWVQQLH-CYBMUJFWSA-N 1 1 331.803 4.023 20 5 EIBDMO Cc1cc(CNc2ccc(Cl)cc2[N+](=O)[O-])cc(N2CCCC2)[nH+]1 ZINC000517208991 1041906569 /nfs/dbraw/zinc/90/65/69/1041906569.db2.gz YDMPYBNXWUBVGN-UHFFFAOYSA-N 1 1 346.818 4.164 20 5 EIBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000464769628 1042149587 /nfs/dbraw/zinc/14/95/87/1042149587.db2.gz IJWFSTUJIRNXCK-KGLIPLIRSA-N 1 1 328.865 4.354 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](C)C[C@@H]1c1ccco1 ZINC000464856895 1042191950 /nfs/dbraw/zinc/19/19/50/1042191950.db2.gz SKYMFWAUXGJLSI-XJKSGUPXSA-N 1 1 330.384 4.170 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C)C[C@@H]1c1ccco1 ZINC000464856895 1042191953 /nfs/dbraw/zinc/19/19/53/1042191953.db2.gz SKYMFWAUXGJLSI-XJKSGUPXSA-N 1 1 330.384 4.170 20 5 EIBDMO Cc1nc2ccc(C[N@@H+](C)Cc3ccccc3[N+](=O)[O-])cc2s1 ZINC000426065331 1042254056 /nfs/dbraw/zinc/25/40/56/1042254056.db2.gz YSGNHJVBTOYZRO-UHFFFAOYSA-N 1 1 327.409 4.145 20 5 EIBDMO Cc1nc2ccc(C[N@H+](C)Cc3ccccc3[N+](=O)[O-])cc2s1 ZINC000426065331 1042254065 /nfs/dbraw/zinc/25/40/65/1042254065.db2.gz YSGNHJVBTOYZRO-UHFFFAOYSA-N 1 1 327.409 4.145 20 5 EIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000506482777 1042497723 /nfs/dbraw/zinc/49/77/23/1042497723.db2.gz UOXDJYWZXZCNFT-SQNIBIBYSA-N 1 1 345.487 4.242 20 5 EIBDMO Cc1csc(C2([NH2+][C@H](C)c3ccc(C)c([N+](=O)[O-])c3)CCC2)n1 ZINC000271930747 1042523710 /nfs/dbraw/zinc/52/37/10/1042523710.db2.gz DNUAYBDNZQBOSV-CYBMUJFWSA-N 1 1 331.441 4.398 20 5 EIBDMO CC(C)([NH2+]Cc1cccc2c1OC(C)(C)C2)c1ccccc1[N+](=O)[O-] ZINC000492192074 1042575074 /nfs/dbraw/zinc/57/50/74/1042575074.db2.gz CZVKPJXYFKASFU-UHFFFAOYSA-N 1 1 340.423 4.333 20 5 EIBDMO C[C@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCS1 ZINC000426391429 1042634267 /nfs/dbraw/zinc/63/42/67/1042634267.db2.gz QWZAWUDEVANSRZ-ZDUSSCGKSA-N 1 1 332.425 4.182 20 5 EIBDMO CCOc1cc(C[NH2+][C@H](C)c2ccccc2Cl)ccc1[N+](=O)[O-] ZINC000492483415 1042669146 /nfs/dbraw/zinc/66/91/46/1042669146.db2.gz KLDSCJYGLHRGSR-GFCCVEGCSA-N 1 1 334.803 4.498 20 5 EIBDMO CCCCOC1CC[NH+](Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000493081526 1042814819 /nfs/dbraw/zinc/81/48/19/1042814819.db2.gz RAOOHLLYGQBBTB-UHFFFAOYSA-N 1 1 326.824 4.029 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2COc3ccc(Cl)cc32)cc1Cl ZINC000761528353 1042876266 /nfs/dbraw/zinc/87/62/66/1042876266.db2.gz RJGBMNMBQWAXTC-CYBMUJFWSA-N 1 1 339.178 4.125 20 5 EIBDMO CCC(C)(C)[C@@H]1CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000441652666 1042958237 /nfs/dbraw/zinc/95/82/37/1042958237.db2.gz BGQISMBDVWYRQW-HNNXBMFYSA-N 1 1 344.415 4.045 20 5 EIBDMO Cc1cnc([C@@H]([NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)C2CC2)s1 ZINC000120941110 1043092366 /nfs/dbraw/zinc/09/23/66/1043092366.db2.gz DIWYDOWPGYYLNL-LRDDRELGSA-N 1 1 331.441 4.470 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]Cc3cccs3)cs2)c1 ZINC000113313801 1043262417 /nfs/dbraw/zinc/26/24/17/1043262417.db2.gz POTGCDZZCWAJEM-UHFFFAOYSA-N 1 1 331.422 4.070 20 5 EIBDMO Cc1ccc(C[N@H+](C)Cn2c3cc([N+](=O)[O-])ccc3oc2=S)s1 ZINC000728048231 1043357018 /nfs/dbraw/zinc/35/70/18/1043357018.db2.gz HHXKGEYAXJGMDF-UHFFFAOYSA-N 1 1 349.437 4.331 20 5 EIBDMO Cc1ccc(C[N@@H+](C)Cn2c3cc([N+](=O)[O-])ccc3oc2=S)s1 ZINC000728048231 1043357031 /nfs/dbraw/zinc/35/70/31/1043357031.db2.gz HHXKGEYAXJGMDF-UHFFFAOYSA-N 1 1 349.437 4.331 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]Cc2nccs2)s1 ZINC000171050378 1043414664 /nfs/dbraw/zinc/41/46/64/1043414664.db2.gz YIEMFRSNXMXWQB-UHFFFAOYSA-N 1 1 331.422 4.070 20 5 EIBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000066531220 1043727329 /nfs/dbraw/zinc/72/73/29/1043727329.db2.gz HUUGNFGFANALFB-OKILXGFUSA-N 1 1 329.400 4.055 20 5 EIBDMO CC(C)Oc1ccccc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429232579 1043733162 /nfs/dbraw/zinc/73/31/62/1043733162.db2.gz UEPGSYYNUZNWCO-UHFFFAOYSA-N 1 1 328.412 4.407 20 5 EIBDMO CCCCOc1ncccc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000173352588 1043913386 /nfs/dbraw/zinc/91/33/86/1043913386.db2.gz VRKBNQOBSXMXFW-CQSZACIVSA-N 1 1 329.400 4.020 20 5 EIBDMO CCc1nccn1[C@H]1CCC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000245519153 1043958578 /nfs/dbraw/zinc/95/85/78/1043958578.db2.gz IKHWHUBLGMWKLH-WBVHZDCISA-N 1 1 342.443 4.060 20 5 EIBDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000766208893 1044485596 /nfs/dbraw/zinc/48/55/96/1044485596.db2.gz ADKNROIVSRZODY-GFCCVEGCSA-N 1 1 334.803 4.017 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C1(c3ccccc3F)CC1)CCC2 ZINC000193093005 1044513112 /nfs/dbraw/zinc/51/31/12/1044513112.db2.gz BDADFVPUIJIFOF-GOSISDBHSA-N 1 1 326.371 4.390 20 5 EIBDMO NC(CCCc1ccccc1)=[NH+]OCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000734834596 1044696100 /nfs/dbraw/zinc/69/61/00/1044696100.db2.gz YGRKBPMZGQPVNC-UHFFFAOYSA-N 1 1 347.802 4.270 20 5 EIBDMO CC(C)C[C@@H]1CCCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000466674708 1044968519 /nfs/dbraw/zinc/96/85/19/1044968519.db2.gz ZXFBOLLNEFAECW-INIZCTEOSA-N 1 1 344.415 4.045 20 5 EIBDMO Cc1cc(C[NH2+][C@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)on1 ZINC000125496100 1045007569 /nfs/dbraw/zinc/00/75/69/1045007569.db2.gz CMQCZPYGJGFRLY-GFCCVEGCSA-N 1 1 343.408 4.471 20 5 EIBDMO CC(C)[C@H]([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)c1ccc(F)cc1 ZINC000509381316 1045068550 /nfs/dbraw/zinc/06/85/50/1045068550.db2.gz XQQSEQNLAQTBLN-KRWDZBQOSA-N 1 1 338.329 4.499 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000611515614 1045321408 /nfs/dbraw/zinc/32/14/08/1045321408.db2.gz HCRBTJQTRCRNFZ-OXJNMPFZSA-N 1 1 340.423 4.428 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cnn(C(C)C)c1 ZINC000542574578 1045427669 /nfs/dbraw/zinc/42/76/69/1045427669.db2.gz RKCVIHYPJRWAOP-AWEZNQCLSA-N 1 1 346.431 4.010 20 5 EIBDMO CC[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000767827727 1045649493 /nfs/dbraw/zinc/64/94/93/1045649493.db2.gz SAWCAWBLLQBJDI-INIZCTEOSA-N 1 1 348.830 4.021 20 5 EIBDMO CC[C@@H](CO)[N@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000767827727 1045649484 /nfs/dbraw/zinc/64/94/84/1045649484.db2.gz SAWCAWBLLQBJDI-INIZCTEOSA-N 1 1 348.830 4.021 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](Nc3ccccc3)C2)ccc1Cl ZINC000768557990 1045820435 /nfs/dbraw/zinc/82/04/35/1045820435.db2.gz YFXIZMDRXUIIQC-INIZCTEOSA-N 1 1 345.830 4.325 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](Nc3ccccc3)C2)ccc1Cl ZINC000768557990 1045820437 /nfs/dbraw/zinc/82/04/37/1045820437.db2.gz YFXIZMDRXUIIQC-INIZCTEOSA-N 1 1 345.830 4.325 20 5 EIBDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000768543721 1045822382 /nfs/dbraw/zinc/82/23/82/1045822382.db2.gz FPBDTUXRQIPGPJ-GFCCVEGCSA-N 1 1 334.803 4.450 20 5 EIBDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000768549155 1045822486 /nfs/dbraw/zinc/82/24/86/1045822486.db2.gz RWQQPDRBFDXXPI-LBPRGKRZSA-N 1 1 334.803 4.017 20 5 EIBDMO C[N@H+](Cc1ccc(F)c(F)c1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000768543583 1045822603 /nfs/dbraw/zinc/82/26/03/1045822603.db2.gz BJWUETQKUUCJLY-UHFFFAOYSA-N 1 1 326.730 4.158 20 5 EIBDMO C[N@@H+](Cc1ccc(F)c(F)c1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000768543583 1045822605 /nfs/dbraw/zinc/82/26/05/1045822605.db2.gz BJWUETQKUUCJLY-UHFFFAOYSA-N 1 1 326.730 4.158 20 5 EIBDMO Cc1ccc([C@H](C)[N@H+](C)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c(C)c1 ZINC000792863295 1046079369 /nfs/dbraw/zinc/07/93/69/1046079369.db2.gz SYHYTKJDHFXJHV-AWEZNQCLSA-N 1 1 343.383 4.313 20 5 EIBDMO Cc1ccc([C@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c(C)c1 ZINC000792863295 1046079387 /nfs/dbraw/zinc/07/93/87/1046079387.db2.gz SYHYTKJDHFXJHV-AWEZNQCLSA-N 1 1 343.383 4.313 20 5 EIBDMO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC001170027840 1046437349 /nfs/dbraw/zinc/43/73/49/1046437349.db2.gz VJNSWEVDAOADFG-IBGZPJMESA-N 1 1 328.412 4.229 20 5 EIBDMO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000459736275 1046875075 /nfs/dbraw/zinc/87/50/75/1046875075.db2.gz ULSFZDKBONOCQI-LBPRGKRZSA-N 1 1 334.803 4.416 20 5 EIBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000787322504 1046993553 /nfs/dbraw/zinc/99/35/53/1046993553.db2.gz QTHLXKJTUWRILK-LBPRGKRZSA-N 1 1 336.741 4.411 20 5 EIBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000787322504 1046993570 /nfs/dbraw/zinc/99/35/70/1046993570.db2.gz QTHLXKJTUWRILK-LBPRGKRZSA-N 1 1 336.741 4.411 20 5 EIBDMO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788665091 1047265388 /nfs/dbraw/zinc/26/53/88/1047265388.db2.gz MFHBSRVXOAQVFU-ZJUUUORDSA-N 1 1 337.782 4.381 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+][C@H]2COCc3cccc(Cl)c32)cc1[N+](=O)[O-] ZINC000788667304 1047267092 /nfs/dbraw/zinc/26/70/92/1047267092.db2.gz UPRQAQXXWCTFRZ-WBMJQRKESA-N 1 1 346.814 4.479 20 5 EIBDMO COc1cccc2cc([C@@H](C)[NH2+]Cc3ccccc3[N+](=O)[O-])oc21 ZINC000194619768 1047403412 /nfs/dbraw/zinc/40/34/12/1047403412.db2.gz QJQYNYWPWJUAMW-GFCCVEGCSA-N 1 1 326.352 4.200 20 5 EIBDMO COc1cccc(C2=CC[N@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000476268815 1047440652 /nfs/dbraw/zinc/44/06/52/1047440652.db2.gz MLBGVWOAOZIMBW-OAHLLOKOSA-N 1 1 338.407 4.454 20 5 EIBDMO COc1ccccc1[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000609280932 1047476470 /nfs/dbraw/zinc/47/64/70/1047476470.db2.gz WXGMMIKGMMHSBS-GOSISDBHSA-N 1 1 326.396 4.331 20 5 EIBDMO CC(C)(CO)[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 ZINC000809655576 1048456073 /nfs/dbraw/zinc/45/60/73/1048456073.db2.gz MNBWZLIYMIPLFB-KRWDZBQOSA-N 1 1 348.830 4.098 20 5 EIBDMO c1ccc2c(c1)cc1ccccc1c2C[N@H+]1CCO[C@]2(CCCOC2)C1 ZINC000809687255 1048473789 /nfs/dbraw/zinc/47/37/89/1048473789.db2.gz WBHYISYOGMGTKR-HSZRJFAPSA-N 1 1 347.458 4.374 20 5 EIBDMO CC[C@@H](O)[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809948110 1048577507 /nfs/dbraw/zinc/57/75/07/1048577507.db2.gz UGJLFPQHPADDIN-UONOGXRCSA-N 1 1 347.242 4.027 20 5 EIBDMO CC[C@@H](O)[C@@H]1CCCC[N@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809948110 1048577521 /nfs/dbraw/zinc/57/75/21/1048577521.db2.gz UGJLFPQHPADDIN-UONOGXRCSA-N 1 1 347.242 4.027 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000609705200 1049277478 /nfs/dbraw/zinc/27/74/78/1049277478.db2.gz FMBUPOHQTOJKQL-INIZCTEOSA-N 1 1 332.787 4.291 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000609705200 1049277495 /nfs/dbraw/zinc/27/74/95/1049277495.db2.gz FMBUPOHQTOJKQL-INIZCTEOSA-N 1 1 332.787 4.291 20 5 EIBDMO C[C@@H]1SCC[N@H+](Cc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000609829401 1049347764 /nfs/dbraw/zinc/34/77/64/1049347764.db2.gz AJNGFQRIJVFFNB-KBXCAEBGSA-N 1 1 328.437 4.273 20 5 EIBDMO C[C@@H]1SCC[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000609829401 1049347777 /nfs/dbraw/zinc/34/77/77/1049347777.db2.gz AJNGFQRIJVFFNB-KBXCAEBGSA-N 1 1 328.437 4.273 20 5 EIBDMO Cc1c(C[N@@H+]2C[C@H](c3ccc(F)cc3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000609916537 1049394805 /nfs/dbraw/zinc/39/48/05/1049394805.db2.gz WOKHAKDQRYAPKR-CXAGYDPISA-N 1 1 328.387 4.420 20 5 EIBDMO CCCC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[C@H](C)C1 ZINC001170683706 1049542430 /nfs/dbraw/zinc/54/24/30/1049542430.db2.gz SZZXNQUQSCGXAB-IPELMVKDSA-N 1 1 334.460 4.309 20 5 EIBDMO CC[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])[C@@H](C)[C@H](O)c1ccccc1 ZINC000812849303 1049611894 /nfs/dbraw/zinc/61/18/94/1049611894.db2.gz NHJVYLGTGWDZDL-UGSOOPFHSA-N 1 1 348.830 4.192 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCc2ccc(F)cc2[C@H](C)C1 ZINC001171670384 1049773666 /nfs/dbraw/zinc/77/36/66/1049773666.db2.gz DNZMJQAFRRKAJV-KGLIPLIRSA-N 1 1 328.387 4.457 20 5 EIBDMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000615802284 1049781172 /nfs/dbraw/zinc/78/11/72/1049781172.db2.gz IMSKPNSVAZFCIX-CQSZACIVSA-N 1 1 346.349 4.027 20 5 EIBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCc3oc(-c4ccccc4)cc3C2)cc1 ZINC001171791203 1049804745 /nfs/dbraw/zinc/80/47/45/1049804745.db2.gz CVVVPGPTSMECKL-UHFFFAOYSA-N 1 1 348.402 4.456 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CC[C@H](c3ccccc3)C1)CC2 ZINC001172909589 1050245253 /nfs/dbraw/zinc/24/52/53/1050245253.db2.gz TYMRMBWNTLAFGW-PMACEKPBSA-N 1 1 336.435 4.332 20 5 EIBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)[C@H]2CC[C@H](C)CC2)c1F ZINC001173194653 1050340168 /nfs/dbraw/zinc/34/01/68/1050340168.db2.gz XRZKCYMRUUKYMU-IHRRRGAJSA-N 1 1 338.423 4.184 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@H]1c1cccnc1 ZINC001173227232 1050356727 /nfs/dbraw/zinc/35/67/27/1050356727.db2.gz OTLVNJPEHGXREI-BEFAXECRSA-N 1 1 325.412 4.148 20 5 EIBDMO CC[N@@H+](Cc1cccc(F)c1F)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173233671 1050362810 /nfs/dbraw/zinc/36/28/10/1050362810.db2.gz XXEKTEDKCUDVMZ-CYBMUJFWSA-N 1 1 334.366 4.326 20 5 EIBDMO CC(C)[C@H]1CN(c2sccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC001187044797 1050465324 /nfs/dbraw/zinc/46/53/24/1050465324.db2.gz PHPVATIABVDNEQ-QGZVFWFLSA-N 1 1 345.468 4.003 20 5 EIBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)[C@H]1C[C@@H]1C ZINC001178561102 1050506594 /nfs/dbraw/zinc/50/65/94/1050506594.db2.gz GAQCIFJEPMLCRD-SJCJKPOMSA-N 1 1 333.435 4.357 20 5 EIBDMO Cc1ncc([C@@H](C)[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)s1 ZINC001179333352 1050677181 /nfs/dbraw/zinc/67/71/81/1050677181.db2.gz VLBQLUMJKSPUDR-LLVKDONJSA-N 1 1 343.408 4.471 20 5 EIBDMO Cc1oc(C(C)(C)C)cc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC001181154146 1051169261 /nfs/dbraw/zinc/16/92/61/1051169261.db2.gz LJHCRUFDUWTGPG-UHFFFAOYSA-N 1 1 330.428 4.468 20 5 EIBDMO CC[N@H+](Cc1cccc(Cl)c1)Cc1ccc([N+](=O)[O-])cc1OC ZINC001190365451 1051170810 /nfs/dbraw/zinc/17/08/10/1051170810.db2.gz KLPXWLPYVAFBCI-UHFFFAOYSA-N 1 1 334.803 4.279 20 5 EIBDMO CC[N@@H+](Cc1cccc(Cl)c1)Cc1ccc([N+](=O)[O-])cc1OC ZINC001190365451 1051170814 /nfs/dbraw/zinc/17/08/14/1051170814.db2.gz KLPXWLPYVAFBCI-UHFFFAOYSA-N 1 1 334.803 4.279 20 5 EIBDMO CC[C@](C)([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 ZINC000775390603 1051194323 /nfs/dbraw/zinc/19/43/23/1051194323.db2.gz OJHSQNIVGPYCRX-SFHVURJKSA-N 1 1 325.368 4.151 20 5 EIBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC3CC2(C)C3)cc1OC ZINC001174799017 1051197334 /nfs/dbraw/zinc/19/73/34/1051197334.db2.gz QVJOXGJMOXCSDO-VFPJAPOESA-N 1 1 348.443 4.013 20 5 EIBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CC3CC2(C)C3)cc1OC ZINC001174799017 1051197350 /nfs/dbraw/zinc/19/73/50/1051197350.db2.gz QVJOXGJMOXCSDO-VFPJAPOESA-N 1 1 348.443 4.013 20 5 EIBDMO CCn1c2ccccc2nc1[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1C ZINC000183647359 1051202140 /nfs/dbraw/zinc/20/21/40/1051202140.db2.gz OPPPLCKWXHXJIJ-CQSZACIVSA-N 1 1 338.411 4.124 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1cc(F)cc(F)c1 ZINC001181446412 1051227938 /nfs/dbraw/zinc/22/79/38/1051227938.db2.gz YKUXFFRMIOOZEO-AWNIVKPZSA-N 1 1 332.350 4.408 20 5 EIBDMO COc1cc(C[N@@H+](CC2CC2)C2CCCCC2)c([N+](=O)[O-])cc1F ZINC001190809832 1051272945 /nfs/dbraw/zinc/27/29/45/1051272945.db2.gz LVHUMOPNHHKSIV-UHFFFAOYSA-N 1 1 336.407 4.287 20 5 EIBDMO CCC1(CC)CC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC001191541023 1051476927 /nfs/dbraw/zinc/47/69/27/1051476927.db2.gz LQZGDTVMAJAUBX-UHFFFAOYSA-N 1 1 341.249 4.369 20 5 EIBDMO C[N@H+]1CCC[C@H](NC(=O)CCc2c3ccccc3cc3ccccc32)C1 ZINC001182412981 1051547210 /nfs/dbraw/zinc/54/72/10/1051547210.db2.gz KINOPSYNRIABQL-IBGZPJMESA-N 1 1 346.474 4.136 20 5 EIBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C1CC(OC(C)(C)C)C1 ZINC001192071208 1051630429 /nfs/dbraw/zinc/63/04/29/1051630429.db2.gz RECDORSAQWYEQB-UHFFFAOYSA-N 1 1 326.824 4.026 20 5 EIBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C1CC(OC(C)(C)C)C1 ZINC001192071208 1051630435 /nfs/dbraw/zinc/63/04/35/1051630435.db2.gz RECDORSAQWYEQB-UHFFFAOYSA-N 1 1 326.824 4.026 20 5 EIBDMO CC(C)[N@H+]1CC[C@H]1C(=O)N(C)Cc1c2ccccc2cc2ccccc21 ZINC001182848426 1051717371 /nfs/dbraw/zinc/71/73/71/1051717371.db2.gz HZUAWDSMWWUQSY-QFIPXVFZSA-N 1 1 346.474 4.434 20 5 EIBDMO CC(C)[C@H]1CCCCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC001192653107 1051781546 /nfs/dbraw/zinc/78/15/46/1051781546.db2.gz LNNWVEHKLNKCRH-MRXNPFEDSA-N 1 1 344.415 4.045 20 5 EIBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H](O)c1ccc(Cl)cc1 ZINC000774576700 1051798857 /nfs/dbraw/zinc/79/88/57/1051798857.db2.gz MZOFLPNHVPQJHB-GOSISDBHSA-N 1 1 348.830 4.192 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCCC[C@H]2CC2(O)CCCCC2)c1 ZINC001176061980 1051900802 /nfs/dbraw/zinc/90/08/02/1051900802.db2.gz MGBHSMCGXVFHOY-SFHVURJKSA-N 1 1 332.444 4.035 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC001184264506 1051981424 /nfs/dbraw/zinc/98/14/24/1051981424.db2.gz DPKHMSBLYXLXBW-MBSJSRAVSA-N 1 1 343.452 4.019 20 5 EIBDMO C[C@H](c1ccccc1)[C@H]1CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001176356846 1052035449 /nfs/dbraw/zinc/03/54/49/1052035449.db2.gz VZAVBHJNEUGKGI-OXQOHEQNSA-N 1 1 340.423 4.242 20 5 EIBDMO Cc1cc(NCC(C)(C)[N@H+]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC001184750360 1052098549 /nfs/dbraw/zinc/09/85/49/1052098549.db2.gz KEFLCNCPSXBBMI-UHFFFAOYSA-N 1 1 339.439 4.152 20 5 EIBDMO CCC[N@H+](Cc1ccc(F)cc1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774839053 1052190708 /nfs/dbraw/zinc/19/07/08/1052190708.db2.gz GCLKVJZOQHCVKS-UHFFFAOYSA-N 1 1 347.346 4.054 20 5 EIBDMO CCC[N@@H+](Cc1ccc(F)cc1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774839053 1052190717 /nfs/dbraw/zinc/19/07/17/1052190717.db2.gz GCLKVJZOQHCVKS-UHFFFAOYSA-N 1 1 347.346 4.054 20 5 EIBDMO Cc1cccnc1[C@H](C)[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC001176896736 1052208328 /nfs/dbraw/zinc/20/83/28/1052208328.db2.gz ICMKPBRPUPJPLM-JTQLQIEISA-N 1 1 340.210 4.456 20 5 EIBDMO CC[C@H]1c2ccccc2CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774884350 1052243295 /nfs/dbraw/zinc/24/32/95/1052243295.db2.gz KTQSBHFQKGKWME-KRWDZBQOSA-N 1 1 341.367 4.012 20 5 EIBDMO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774884350 1052243305 /nfs/dbraw/zinc/24/33/05/1052243305.db2.gz KTQSBHFQKGKWME-KRWDZBQOSA-N 1 1 341.367 4.012 20 5 EIBDMO CC(C)[C@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000444750834 1052770874 /nfs/dbraw/zinc/77/08/74/1052770874.db2.gz KOFSERQJUFAFJW-HNNXBMFYSA-N 1 1 329.400 4.118 20 5 EIBDMO CCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccccc1 ZINC000083127919 1052830215 /nfs/dbraw/zinc/83/02/15/1052830215.db2.gz FYSZJNWJHALHEQ-UHFFFAOYSA-N 1 1 325.368 4.148 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@H]3c3ccsc3)nc2c1 ZINC000083168625 1052846985 /nfs/dbraw/zinc/84/69/85/1052846985.db2.gz OBQLJXLHUUZCQU-AWEZNQCLSA-N 1 1 329.381 4.135 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H]3c3ccsc3)nc2c1 ZINC000083168625 1052846990 /nfs/dbraw/zinc/84/69/90/1052846990.db2.gz OBQLJXLHUUZCQU-AWEZNQCLSA-N 1 1 329.381 4.135 20 5 EIBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccc2c(c1)CCCO2 ZINC000850463182 1053239844 /nfs/dbraw/zinc/23/98/44/1053239844.db2.gz XKDDPYDXGDZQSZ-LBPRGKRZSA-N 1 1 346.814 4.424 20 5 EIBDMO C[C@@H]1CCCCC[N@@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159430769 1053341089 /nfs/dbraw/zinc/34/10/89/1053341089.db2.gz OVIBFLMPPNCSLS-LLVKDONJSA-N 1 1 327.222 4.122 20 5 EIBDMO C[C@@H]1CCCCC[N@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159430769 1053341110 /nfs/dbraw/zinc/34/11/10/1053341110.db2.gz OVIBFLMPPNCSLS-LLVKDONJSA-N 1 1 327.222 4.122 20 5 EIBDMO COc1cc(C[N@@H+](C)[C@H]2CCC[C@@H]2C(C)(C)C)c([N+](=O)[O-])cc1F ZINC001195279897 1053359484 /nfs/dbraw/zinc/35/94/84/1053359484.db2.gz PNCQHIXZSQNDTQ-ZFWWWQNUSA-N 1 1 338.423 4.389 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@H]([C@@H]3CCCCO3)C2)c1 ZINC000852596380 1053595261 /nfs/dbraw/zinc/59/52/61/1053595261.db2.gz LHLYVIYHZCBXEM-GUYCJALGSA-N 1 1 338.835 4.029 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCCCC[C@H]2C[C@H](O)c2ccco2)c1 ZINC000121794849 1053847690 /nfs/dbraw/zinc/84/76/90/1053847690.db2.gz FWOXDNGBUUWYTL-WMZOPIPTSA-N 1 1 344.411 4.056 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CCCCC[C@H]1C[C@H](O)c1ccco1 ZINC000121951359 1053862701 /nfs/dbraw/zinc/86/27/01/1053862701.db2.gz OHBRNAVZDXIMIO-WMZOPIPTSA-N 1 1 344.411 4.056 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CCCCC[C@@H]1C[C@H](O)c1ccco1 ZINC000121951156 1053863641 /nfs/dbraw/zinc/86/36/41/1053863641.db2.gz OHBRNAVZDXIMIO-AEFFLSMTSA-N 1 1 344.411 4.056 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C)[C@@H]1c1ccccc1 ZINC001197661367 1053961020 /nfs/dbraw/zinc/96/10/20/1053961020.db2.gz UTKLFGQQKTXJRP-IFXJQAMLSA-N 1 1 326.396 4.187 20 5 EIBDMO O=[N+]([O-])c1cccc(OCC[N@@H+](Cc2cccc(F)c2)C2CCC2)c1 ZINC001197958747 1054037670 /nfs/dbraw/zinc/03/76/70/1054037670.db2.gz CYZQKXAJVWQKGR-UHFFFAOYSA-N 1 1 344.386 4.167 20 5 EIBDMO CCc1nc(C)c(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2SC)o1 ZINC000872072756 1054378609 /nfs/dbraw/zinc/37/86/09/1054378609.db2.gz JNPHFBQDUABZRZ-JTQLQIEISA-N 1 1 335.429 4.026 20 5 EIBDMO CCC[C@H](C)[C@H]1CCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878199475 1055204468 /nfs/dbraw/zinc/20/44/68/1055204468.db2.gz AZFIDPDXQGZACE-DZGCQCFKSA-N 1 1 344.415 4.045 20 5 EIBDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(c2sccc2[N+](=O)[O-])CC1 ZINC000302021720 1055546398 /nfs/dbraw/zinc/54/63/98/1055546398.db2.gz OFLOMVQISDSRPJ-CQSZACIVSA-N 1 1 337.489 4.137 20 5 EIBDMO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)CCC2 ZINC000765818779 1055564578 /nfs/dbraw/zinc/56/45/78/1055564578.db2.gz OOMJEIFVDLYEHG-DYVFJYSZSA-N 1 1 328.416 4.100 20 5 EIBDMO C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000301561589 1055734810 /nfs/dbraw/zinc/73/48/10/1055734810.db2.gz UXKWDNSFYFRHCI-YJBOKZPZSA-N 1 1 325.412 4.060 20 5 EIBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273409116 1055802523 /nfs/dbraw/zinc/80/25/23/1055802523.db2.gz HZWNMMWWHFWJDQ-HKUYNNGSSA-N 1 1 344.386 4.086 20 5 EIBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000542697522 1055838604 /nfs/dbraw/zinc/83/86/04/1055838604.db2.gz NPFPATYWOXFOLG-LJQANCHMSA-N 1 1 326.396 4.249 20 5 EIBDMO COc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000542701153 1055842524 /nfs/dbraw/zinc/84/25/24/1055842524.db2.gz ZNRGLAAJIHZRFG-SFHVURJKSA-N 1 1 326.396 4.249 20 5 EIBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)c1ccc(C)cc1 ZINC000743863604 1059194929 /nfs/dbraw/zinc/19/49/29/1059194929.db2.gz BEALYLATHSTRFL-SFHVURJKSA-N 1 1 348.830 4.112 20 5 EIBDMO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)c1ccc(C)cc1 ZINC000743863604 1059194958 /nfs/dbraw/zinc/19/49/58/1059194958.db2.gz BEALYLATHSTRFL-SFHVURJKSA-N 1 1 348.830 4.112 20 5 EIBDMO C[N@@H+](Cc1ccc(Oc2ccccc2)cc1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169037070 1060593077 /nfs/dbraw/zinc/59/30/77/1060593077.db2.gz IOWGFBKHAGBIPW-ZWKOTPCHSA-N 1 1 340.423 4.356 20 5 EIBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Br)c1ccsc1 ZINC001169715242 1060917112 /nfs/dbraw/zinc/91/71/12/1060917112.db2.gz KFZFJPTZFBEGDL-SECBINFHSA-N 1 1 341.230 4.270 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Br)c1ccsc1 ZINC000061363061 214661683 /nfs/dbraw/zinc/66/16/83/214661683.db2.gz WBFIGISHORERCA-SECBINFHSA-N 1 1 341.230 4.270 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cc2cccc(F)c2o1 ZINC000475692861 1032160016 /nfs/dbraw/zinc/16/00/16/1032160016.db2.gz BYVYHIQLGGTTNJ-LLVKDONJSA-N 1 1 344.342 4.340 20 5 EIBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCCCC[C@H]1/C=C/c1ccccc1 ZINC001168144166 1032208630 /nfs/dbraw/zinc/20/86/30/1032208630.db2.gz BYJPRQZWGTYQCZ-HYSAVQALSA-N 1 1 337.423 4.448 20 5 EIBDMO CC(C)CC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000533243493 1032558886 /nfs/dbraw/zinc/55/88/86/1032558886.db2.gz PCWLAPBPNVPGSV-UHFFFAOYSA-N 1 1 343.427 4.303 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]C1(c2ccc(Cl)cc2)CC1 ZINC000557538656 1018724879 /nfs/dbraw/zinc/72/48/79/1018724879.db2.gz XQPLLTXQOOQUFW-UHFFFAOYSA-N 1 1 332.787 4.036 20 5 EIBDMO CSC[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000430192473 1019109643 /nfs/dbraw/zinc/10/96/43/1019109643.db2.gz ATQIIDKRHQZIRB-AWEZNQCLSA-N 1 1 346.452 4.430 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1cccc(OC(C)C)c1 ZINC000430202126 1019261297 /nfs/dbraw/zinc/26/12/97/1019261297.db2.gz FJWJGSCBDVRXMH-UHFFFAOYSA-N 1 1 344.411 4.023 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1cccc(OC(C)C)c1 ZINC000430202126 1019261313 /nfs/dbraw/zinc/26/13/13/1019261313.db2.gz FJWJGSCBDVRXMH-UHFFFAOYSA-N 1 1 344.411 4.023 20 5 EIBDMO COc1ccc(C[N@H+]2C[C@@H](c3ccccc3C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000610001849 1021082476 /nfs/dbraw/zinc/08/24/76/1021082476.db2.gz FSVAOAYWJIJSCN-WBVHZDCISA-N 1 1 340.423 4.290 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC001167332709 1021199685 /nfs/dbraw/zinc/19/96/85/1021199685.db2.gz QKGGYLQBXQJJQR-QGZVFWFLSA-N 1 1 340.423 4.058 20 5 EIBDMO C[C@H](CCN[C@@H](C)c1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccccc1 ZINC000379624339 1021846406 /nfs/dbraw/zinc/84/64/06/1021846406.db2.gz JNFDVRMFDKRYKF-SJORKVTESA-N 1 1 341.455 4.156 20 5 EIBDMO CC(C)CC[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001167906747 1033029986 /nfs/dbraw/zinc/02/99/86/1033029986.db2.gz ZRIOQRKVSHQAAL-HNNXBMFYSA-N 1 1 335.404 4.294 20 5 EIBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1cnn(C2CCC2)c1 ZINC000925512548 1022302042 /nfs/dbraw/zinc/30/20/42/1022302042.db2.gz CRKISYICTCLDQO-NSHDSACASA-N 1 1 334.807 4.021 20 5 EIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cccc(-c2cccnc2)c1 ZINC000549407635 1022600322 /nfs/dbraw/zinc/60/03/22/1022600322.db2.gz HJTAVBVMTOEDBO-UHFFFAOYSA-N 1 1 347.418 4.331 20 5 EIBDMO CC[C@H]1CCCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104661199 1022673368 /nfs/dbraw/zinc/67/33/68/1022673368.db2.gz YCHBCWHLAZOUGT-HNNXBMFYSA-N 1 1 329.400 4.057 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+](C3CC3)C3CCCC3)o2)c1 ZINC000104667597 1022674102 /nfs/dbraw/zinc/67/41/02/1022674102.db2.gz TVGVRXNXGLUOEN-UHFFFAOYSA-N 1 1 341.411 4.199 20 5 EIBDMO C[C@H]1CCCC[C@H]1[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104666746 1022674431 /nfs/dbraw/zinc/67/44/31/1022674431.db2.gz VIGYAQRAMWPCCT-WMLDXEAASA-N 1 1 343.427 4.303 20 5 EIBDMO CCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1C[C@H](OCC)C1(C)C ZINC001167443292 1022808528 /nfs/dbraw/zinc/80/85/28/1022808528.db2.gz RMDQIBORKPLOPS-ROUUACIJSA-N 1 1 334.460 4.053 20 5 EIBDMO COCC1=CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000187613209 1023887154 /nfs/dbraw/zinc/88/71/54/1023887154.db2.gz TVFLPEBPHMOWRQ-UHFFFAOYSA-N 1 1 344.436 4.102 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc(Cl)s1 ZINC000047943421 1024373020 /nfs/dbraw/zinc/37/30/20/1024373020.db2.gz PVLYANDNXRJKFX-SECBINFHSA-N 1 1 326.805 4.169 20 5 EIBDMO COC1CCC([N@@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000093414979 1024434017 /nfs/dbraw/zinc/43/40/17/1024434017.db2.gz XXFQHRMKWUSFQM-UHFFFAOYSA-N 1 1 344.411 4.244 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc(F)c(Cl)c1 ZINC000112533293 1024719196 /nfs/dbraw/zinc/71/91/96/1024719196.db2.gz CQDMIRJWAUMGOS-JTQLQIEISA-N 1 1 338.766 4.247 20 5 EIBDMO CCOc1cc(C[NH2+][C@H](C)c2ccc(F)cc2F)ccc1[N+](=O)[O-] ZINC000276922171 1024760055 /nfs/dbraw/zinc/76/00/55/1024760055.db2.gz PILXSFUGQIVFJF-LLVKDONJSA-N 1 1 336.338 4.123 20 5 EIBDMO Cc1cccc(N2CCC(Nc3c(Cl)cccc3[N+](=O)[O-])CC2)[nH+]1 ZINC000432332412 1025608153 /nfs/dbraw/zinc/60/81/53/1025608153.db2.gz XPJAIYUYETXQFF-UHFFFAOYSA-N 1 1 346.818 4.033 20 5 EIBDMO COCCCC[N@@H+](Cc1ccccc1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000512066705 1025869783 /nfs/dbraw/zinc/86/97/83/1025869783.db2.gz GRMAZWXFZUTNAO-UHFFFAOYSA-N 1 1 342.439 4.332 20 5 EIBDMO COc1ccc(C[N@@H+](Cc2cccc(F)c2)C(C)C)cc1[N+](=O)[O-] ZINC000507154686 1026676047 /nfs/dbraw/zinc/67/60/47/1026676047.db2.gz KKQMKRGVYAJBEZ-UHFFFAOYSA-N 1 1 332.375 4.153 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1sccc1Br ZINC000050015622 1026680689 /nfs/dbraw/zinc/68/06/89/1026680689.db2.gz BLURLDOVTDMNFE-SECBINFHSA-N 1 1 341.230 4.270 20 5 EIBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000178571630 1026692738 /nfs/dbraw/zinc/69/27/38/1026692738.db2.gz RQCHSISSBQGNFO-MSOLQXFVSA-N 1 1 346.814 4.119 20 5 EIBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCCCC[C@H]2c2ccc(Cl)cc2)c1 ZINC000472253988 1027220243 /nfs/dbraw/zinc/22/02/43/1027220243.db2.gz BFJLDWXMTPCMOR-KRWDZBQOSA-N 1 1 348.834 4.062 20 5 EIBDMO C[C@H]1[C@@H](Cc2ccccc2)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC001167619968 1027372417 /nfs/dbraw/zinc/37/24/17/1027372417.db2.gz OGKUUKOJQZYGLV-GOEBONIOSA-N 1 1 328.387 4.187 20 5 EIBDMO COc1ccc(C[N@H+](Cc2ccc(F)cc2)CC2CC2)cc1[N+](=O)[O-] ZINC000522466361 1027420835 /nfs/dbraw/zinc/42/08/35/1027420835.db2.gz MLKSBZJAWCJPAD-UHFFFAOYSA-N 1 1 344.386 4.155 20 5 EIBDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000441323434 1027449031 /nfs/dbraw/zinc/44/90/31/1027449031.db2.gz MZZHQXBTCKIITJ-RDTXWAMCSA-N 1 1 344.386 4.196 20 5 EIBDMO C[C@H]([NH2+]Cc1sccc1Br)c1ccc([N+](=O)[O-])cc1 ZINC000094259805 1027530022 /nfs/dbraw/zinc/53/00/22/1027530022.db2.gz LGRYDVBDTLXUHT-VIFPVBQESA-N 1 1 341.230 4.270 20 5 EIBDMO CC(C)c1ccc(CN[C@@H](CC[NH+](C)C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000522557807 1028003592 /nfs/dbraw/zinc/00/35/92/1028003592.db2.gz HSFGOAGVYYBIMQ-SFHVURJKSA-N 1 1 335.492 4.174 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000444712962 1028004895 /nfs/dbraw/zinc/00/48/95/1028004895.db2.gz XNEVFMDXYDBEAV-LBPRGKRZSA-N 1 1 346.349 4.156 20 5 EIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000444712962 1028004916 /nfs/dbraw/zinc/00/49/16/1028004916.db2.gz XNEVFMDXYDBEAV-LBPRGKRZSA-N 1 1 346.349 4.156 20 5 EIBDMO CC(C)[C@@H]1CCC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000444749605 1028034969 /nfs/dbraw/zinc/03/49/69/1028034969.db2.gz UBNTYOMNQRJPGN-UKRRQHHQSA-N 1 1 344.415 4.074 20 5 EIBDMO Cc1ccc(C)c([C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)[C@@H](C)CO2)c1 ZINC000441461894 1028070472 /nfs/dbraw/zinc/07/04/72/1028070472.db2.gz HRTZTGWQBKRZRK-OXJNMPFZSA-N 1 1 340.423 4.174 20 5 EIBDMO Cc1ccc(C)c([C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)[C@@H](C)CO2)c1 ZINC000441461894 1028070494 /nfs/dbraw/zinc/07/04/94/1028070494.db2.gz HRTZTGWQBKRZRK-OXJNMPFZSA-N 1 1 340.423 4.174 20 5 EIBDMO Cc1ccccc1[C@H]1C[C@H](C)[N@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000523442076 1028118441 /nfs/dbraw/zinc/11/84/41/1028118441.db2.gz KDEPVSHEBMZMJP-IRXDYDNUSA-N 1 1 340.423 4.160 20 5 EIBDMO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1nccn1-c1ccccc1 ZINC000346948530 1028828010 /nfs/dbraw/zinc/82/80/10/1028828010.db2.gz QFZCHXSLWGBTML-HUUCEWRRSA-N 1 1 336.395 4.192 20 5 EIBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)cc1 ZINC000524425155 1028916734 /nfs/dbraw/zinc/91/67/34/1028916734.db2.gz XDHZZYCLGUGUHT-MRXNPFEDSA-N 1 1 330.815 4.280 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCO[C@H](c3ccccc3)C2)c(Cl)c1 ZINC000611782065 1029036617 /nfs/dbraw/zinc/03/66/17/1029036617.db2.gz DNHIFAYOPDLQRR-SFHVURJKSA-N 1 1 346.814 4.212 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCO[C@H](c3ccccc3)C2)c(Cl)c1 ZINC000611782065 1029036626 /nfs/dbraw/zinc/03/66/26/1029036626.db2.gz DNHIFAYOPDLQRR-SFHVURJKSA-N 1 1 346.814 4.212 20 5 EIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCCCC(C)(C)C1 ZINC000446074973 1029133375 /nfs/dbraw/zinc/13/33/75/1029133375.db2.gz USSQLKQBMZJAQF-ZDUSSCGKSA-N 1 1 344.415 4.218 20 5 EIBDMO Cc1c(C[NH2+]Cc2sccc2Br)cccc1[N+](=O)[O-] ZINC000148185938 1029351212 /nfs/dbraw/zinc/35/12/12/1029351212.db2.gz AYABOLRPTHOXND-UHFFFAOYSA-N 1 1 341.230 4.017 20 5 EIBDMO C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000523008758 1029363705 /nfs/dbraw/zinc/36/37/05/1029363705.db2.gz BGWWIUVELLLCKN-PBHICJAKSA-N 1 1 328.387 4.154 20 5 EIBDMO C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000523008760 1029363819 /nfs/dbraw/zinc/36/38/19/1029363819.db2.gz BGWWIUVELLLCKN-RHSMWYFYSA-N 1 1 328.387 4.154 20 5 EIBDMO C[C@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])CC[C@@H]1c1ccccc1 ZINC000525123365 1029464965 /nfs/dbraw/zinc/46/49/65/1029464965.db2.gz YVGGZWROPQPRDT-WMZOPIPTSA-N 1 1 340.423 4.099 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@H]4CCC[C@@H]43)cs2)c1 ZINC000428451747 1029535096 /nfs/dbraw/zinc/53/50/96/1029535096.db2.gz FKKQQIOKMKOKLE-WBMJQRKESA-N 1 1 329.425 4.093 20 5 EIBDMO CC(C)O[C@H](C[N@@H+](C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000428452553 1029549158 /nfs/dbraw/zinc/54/91/58/1029549158.db2.gz LYNHSWUJUWBITL-LJQANCHMSA-N 1 1 328.412 4.193 20 5 EIBDMO CC(C)c1noc([C@H](C)[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451546442 1030564494 /nfs/dbraw/zinc/56/44/94/1030564494.db2.gz JHXMZEOAFRGECE-ZFWWWQNUSA-N 1 1 344.415 4.042 20 5 EIBDMO CC(C)c1noc([C@H](C)[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451546442 1030564516 /nfs/dbraw/zinc/56/45/16/1030564516.db2.gz JHXMZEOAFRGECE-ZFWWWQNUSA-N 1 1 344.415 4.042 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@@H]2CCC2CCCC2)cc1 ZINC001168175581 1030682194 /nfs/dbraw/zinc/68/21/94/1030682194.db2.gz OKNQIRVEPUWKCA-MJGOQNOKSA-N 1 1 332.444 4.063 20 5 EIBDMO COc1cc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])ccc1OC(C)C ZINC000179315090 1030898082 /nfs/dbraw/zinc/89/80/82/1030898082.db2.gz INYIWEWHSBAKGP-UHFFFAOYSA-N 1 1 344.411 4.023 20 5 EIBDMO COc1cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])ccc1OC(C)C ZINC000179315090 1030898084 /nfs/dbraw/zinc/89/80/84/1030898084.db2.gz INYIWEWHSBAKGP-UHFFFAOYSA-N 1 1 344.411 4.023 20 5 EIBDMO CCC(CC)[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)CC(C)C ZINC000531140051 1030909173 /nfs/dbraw/zinc/90/91/73/1030909173.db2.gz BBPRCDYPFMNCAI-UHFFFAOYSA-N 1 1 336.432 4.108 20 5 EIBDMO Cc1ncsc1C[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000179426742 1031061048 /nfs/dbraw/zinc/06/10/48/1031061048.db2.gz IDGXRMBEYLVIDZ-UHFFFAOYSA-N 1 1 343.408 4.252 20 5 EIBDMO Cc1ncsc1C[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000179426742 1031061061 /nfs/dbraw/zinc/06/10/61/1031061061.db2.gz IDGXRMBEYLVIDZ-UHFFFAOYSA-N 1 1 343.408 4.252 20 5 EIBDMO CC(C)(C)[C@@H]1CCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000532578014 1031310394 /nfs/dbraw/zinc/31/03/94/1031310394.db2.gz OINSKJVGADIJQT-KRWDZBQOSA-N 1 1 343.427 4.303 20 5 EIBDMO C[C@@H]([NH2+][C@@H]1CCc2cc(F)c(F)c(F)c21)c1cccc([N+](=O)[O-])c1 ZINC000449087646 1031449429 /nfs/dbraw/zinc/44/94/29/1031449429.db2.gz GTLASYYPSVKION-YMTOWFKASA-N 1 1 336.313 4.350 20 5 EIBDMO C[C@H]([NH2+][C@H]1CCc2cc(F)c(F)c(F)c21)c1ccc([N+](=O)[O-])cc1 ZINC000449347908 1031646663 /nfs/dbraw/zinc/64/66/63/1031646663.db2.gz JRTUKGFSVLOVCL-XPTSAGLGSA-N 1 1 336.313 4.350 20 5 EIBDMO C[C@@H]1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2O1 ZINC000449421787 1031735362 /nfs/dbraw/zinc/73/53/62/1031735362.db2.gz BKJILBAYTXQWNF-BDJLRTHQSA-N 1 1 332.787 4.250 20 5 EIBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1(C)C ZINC000449506691 1031814701 /nfs/dbraw/zinc/81/47/01/1031814701.db2.gz ZKMOMGKESLLEMT-SFHVURJKSA-N 1 1 344.411 4.102 20 5 EIBDMO CCCc1ncc(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)o1 ZINC000453352162 1031880397 /nfs/dbraw/zinc/88/03/97/1031880397.db2.gz CHRUQVCTJICCGP-MRXNPFEDSA-N 1 1 329.400 4.048 20 5 EIBDMO C[C@H]1CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H]1C ZINC000512643515 1033599104 /nfs/dbraw/zinc/59/91/04/1033599104.db2.gz DMZRZZMACMCFLU-STQMWFEESA-N 1 1 331.441 4.339 20 5 EIBDMO C[N@H+]1CC[C@H](Nc2nc3ccccc3cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000473519195 1034739817 /nfs/dbraw/zinc/73/98/17/1034739817.db2.gz MYHSLWFUFZJFLR-PKOBYXMFSA-N 1 1 348.406 4.000 20 5 EIBDMO C[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccncc1F ZINC000509935012 1035016035 /nfs/dbraw/zinc/01/60/35/1035016035.db2.gz QMGBWMPJYHRHFY-LBPRGKRZSA-N 1 1 341.342 4.240 20 5 EIBDMO CCOCc1ccccc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000236989998 1035230179 /nfs/dbraw/zinc/23/01/79/1035230179.db2.gz ASAUHWCWCJWMAB-UHFFFAOYSA-N 1 1 334.803 4.075 20 5 EIBDMO Cc1c(C[N@@H+](C)CCOc2cccc(Cl)c2)cccc1[N+](=O)[O-] ZINC000501451368 1035446506 /nfs/dbraw/zinc/44/65/06/1035446506.db2.gz QVKRGGYAZXKNQM-UHFFFAOYSA-N 1 1 334.803 4.067 20 5 EIBDMO CCC[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC)c1ccccn1 ZINC000595015054 1035508496 /nfs/dbraw/zinc/50/84/96/1035508496.db2.gz XQRVCWOUQWZBNO-SUMWQHHRSA-N 1 1 329.400 4.190 20 5 EIBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1C(F)(F)F ZINC000059402468 1035523596 /nfs/dbraw/zinc/52/35/96/1035523596.db2.gz AVFSZEFNWMFNLM-UHFFFAOYSA-N 1 1 338.329 4.288 20 5 EIBDMO Cc1cc(N[C@@H](Cc2[nH+]ccn2C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000078558761 1035608790 /nfs/dbraw/zinc/60/87/90/1035608790.db2.gz OKMQNQPPHYPEEY-KRWDZBQOSA-N 1 1 336.395 4.033 20 5 EIBDMO Cc1noc(C[N@H+]2CCC[C@@H]2c2cccc3ccccc32)c1[N+](=O)[O-] ZINC000595295683 1035619803 /nfs/dbraw/zinc/61/98/03/1035619803.db2.gz OYBJRGMRRXDFOL-QGZVFWFLSA-N 1 1 337.379 4.382 20 5 EIBDMO CC[C@@H](c1ccccc1)[C@H]1CCC[N@H+]1Cc1onc(C)c1[N+](=O)[O-] ZINC000595297328 1035627765 /nfs/dbraw/zinc/62/77/65/1035627765.db2.gz RHWFDLMKOCGLGP-JKSUJKDBSA-N 1 1 329.400 4.049 20 5 EIBDMO CCc1ccc([C@H]2CCCCC[N@@H+]2Cc2onc(C)c2[N+](=O)[O-])o1 ZINC000595326398 1035631365 /nfs/dbraw/zinc/63/13/65/1035631365.db2.gz BZQCEJLCFKIHBG-CQSZACIVSA-N 1 1 333.388 4.164 20 5 EIBDMO CCc1ccc([C@H]2CCCCC[N@H+]2Cc2onc(C)c2[N+](=O)[O-])o1 ZINC000595326398 1035631382 /nfs/dbraw/zinc/63/13/82/1035631382.db2.gz BZQCEJLCFKIHBG-CQSZACIVSA-N 1 1 333.388 4.164 20 5 EIBDMO Cc1noc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)c1[N+](=O)[O-] ZINC000595414682 1035672355 /nfs/dbraw/zinc/67/23/55/1035672355.db2.gz JLUPHYFTOQOCHU-OAHLLOKOSA-N 1 1 335.791 4.176 20 5 EIBDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1Cl ZINC000485080891 1035675706 /nfs/dbraw/zinc/67/57/06/1035675706.db2.gz SMSJRWCSXLTRSN-LBPRGKRZSA-N 1 1 334.803 4.450 20 5 EIBDMO CC[N@@H+](CCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000491002032 1035768742 /nfs/dbraw/zinc/76/87/42/1035768742.db2.gz AGLKPGJAYWHCEX-HXUWFJFHSA-N 1 1 341.455 4.004 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2nc3c(s2)CCC3)cc1[N+](=O)[O-] ZINC000502016861 1035807663 /nfs/dbraw/zinc/80/76/63/1035807663.db2.gz LGNFSHKLKBJJCG-NEPJUHHUSA-N 1 1 331.441 4.260 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2nc3c(s2)CCC3)cc1[N+](=O)[O-] ZINC000502016867 1035808303 /nfs/dbraw/zinc/80/83/03/1035808303.db2.gz LGNFSHKLKBJJCG-VXGBXAGGSA-N 1 1 331.441 4.260 20 5 EIBDMO Cc1[nH+]ccn1CCCCNc1ccc(C(F)(F)F)c([N+](=O)[O-])c1 ZINC000596137343 1035824558 /nfs/dbraw/zinc/82/45/58/1035824558.db2.gz SAZAAJXZAFBQMQ-UHFFFAOYSA-N 1 1 342.321 4.011 20 5 EIBDMO CC(C)[N@H+](Cc1c(C2CCC2)cnn1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000596980399 1036063032 /nfs/dbraw/zinc/06/30/32/1036063032.db2.gz ZSKOYNQWKVZCHP-UHFFFAOYSA-N 1 1 342.443 4.006 20 5 EIBDMO CC(C)[N@@H+](Cc1c(C2CCC2)cnn1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000596980399 1036063052 /nfs/dbraw/zinc/06/30/52/1036063052.db2.gz ZSKOYNQWKVZCHP-UHFFFAOYSA-N 1 1 342.443 4.006 20 5 EIBDMO COc1cc(C[N@H+](C)[C@H](C)c2ccccc2Cl)ccc1[N+](=O)[O-] ZINC000485736161 1036229215 /nfs/dbraw/zinc/22/92/15/1036229215.db2.gz HJVKIDIVJGJNIJ-GFCCVEGCSA-N 1 1 334.803 4.450 20 5 EIBDMO COc1cc(C[N@@H+](C)[C@H](C)c2ccccc2Cl)ccc1[N+](=O)[O-] ZINC000485736161 1036229238 /nfs/dbraw/zinc/22/92/38/1036229238.db2.gz HJVKIDIVJGJNIJ-GFCCVEGCSA-N 1 1 334.803 4.450 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3ncccc3Cl)CC2)cc1F ZINC000366971526 1036448507 /nfs/dbraw/zinc/44/85/07/1036448507.db2.gz YZEMPYKVBMRNGV-UHFFFAOYSA-N 1 1 349.793 4.162 20 5 EIBDMO Cc1ccc(CNc2c(Cl)cccc2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000590083088 1036957178 /nfs/dbraw/zinc/95/71/78/1036957178.db2.gz OEMLTRQCOVODMR-UHFFFAOYSA-N 1 1 346.818 4.164 20 5 EIBDMO Cc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(Br)c1 ZINC000231884217 1037008334 /nfs/dbraw/zinc/00/83/34/1037008334.db2.gz FARAXDIMKWQXME-UHFFFAOYSA-N 1 1 349.228 4.264 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2cc(F)ccc2F)cc(C(F)(F)F)c1 ZINC000487148799 1037019015 /nfs/dbraw/zinc/01/90/15/1037019015.db2.gz AAVYHEVJSSDSRY-UHFFFAOYSA-N 1 1 346.255 4.182 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H](C)c1cccc(Cl)c1 ZINC000603859221 1037054326 /nfs/dbraw/zinc/05/43/26/1037054326.db2.gz UUTAURYVRKUKOQ-LBPRGKRZSA-N 1 1 334.803 4.450 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H](C)c1cccc(Cl)c1 ZINC000603859221 1037054347 /nfs/dbraw/zinc/05/43/47/1037054347.db2.gz UUTAURYVRKUKOQ-LBPRGKRZSA-N 1 1 334.803 4.450 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC(C[NH+]2CCCCCC2)CC1 ZINC000603875745 1037067323 /nfs/dbraw/zinc/06/73/23/1037067323.db2.gz NHTNHFVPZFTKNK-QGZVFWFLSA-N 1 1 345.487 4.244 20 5 EIBDMO CCC[N@@H+](Cc1ccc(OC)cc1)Cc1cccc([N+](=O)[O-])c1C ZINC000603925861 1037096647 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ZINC000611497763 1045318746 /nfs/dbraw/zinc/31/87/46/1045318746.db2.gz WYOSUHRLFWNTDY-UHFFFAOYSA-N 1 1 332.375 4.201 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000611515613 1045321464 /nfs/dbraw/zinc/32/14/64/1045321464.db2.gz HCRBTJQTRCRNFZ-JXFKEZNVSA-N 1 1 340.423 4.428 20 5 EIBDMO CC[NH+](CC)C[C@H](C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000609222358 1045416087 /nfs/dbraw/zinc/41/60/87/1045416087.db2.gz FRPBTBDLZFQNOI-AWEZNQCLSA-N 1 1 347.484 4.143 20 5 EIBDMO OCC[N@@H+](Cc1cccnc1)Cc1c2ccccc2cc2ccccc21 ZINC000769331613 1045923638 /nfs/dbraw/zinc/92/36/38/1045923638.db2.gz UKVYROMESCKEEB-UHFFFAOYSA-N 1 1 342.442 4.383 20 5 EIBDMO CCCO[C@@H]1CCC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000153873937 1045932990 /nfs/dbraw/zinc/93/29/90/1045932990.db2.gz QAGYMJPXASXMNE-CQSZACIVSA-N 1 1 326.824 4.029 20 5 EIBDMO COc1ccc(C[C@H](C)[N@@H+](C)C/C=C/c2ccccc2)c([N+](=O)[O-])c1 ZINC001170352815 1046007679 /nfs/dbraw/zinc/00/76/79/1046007679.db2.gz RDIXPLQQYVOFDG-JCVNQNCUSA-N 1 1 340.423 4.180 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3ccc(CF)cc3)C2)cc1 ZINC001170423883 1046121451 /nfs/dbraw/zinc/12/14/51/1046121451.db2.gz JUYZXDMXKZTJJB-GOSISDBHSA-N 1 1 328.387 4.444 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3ccc4cc[nH]c4c3)C2)cc1 ZINC001170425267 1046136597 /nfs/dbraw/zinc/13/65/97/1046136597.db2.gz SJSVDSTYYCBWPB-GOSISDBHSA-N 1 1 335.407 4.456 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2c3ccccc3cc3ccccc32)C[C@@]2(CCOC2)O1 ZINC000793362880 1046214626 /nfs/dbraw/zinc/21/46/26/1046214626.db2.gz OYVDDAGPTQSERQ-UZUQRXQVSA-N 1 1 347.458 4.373 20 5 EIBDMO C[C@]12CC[N@H+](C/C=C\c3ccccc3[N+](=O)[O-])C[C@H]1C2(Cl)Cl ZINC000793613438 1046310579 /nfs/dbraw/zinc/31/05/79/1046310579.db2.gz MOAZCZHOQPDHIU-VASHYATMSA-N 1 1 341.238 4.124 20 5 EIBDMO C[C@]12CC[N@@H+](C/C=C\c3ccccc3[N+](=O)[O-])C[C@H]1C2(Cl)Cl ZINC000793613438 1046310596 /nfs/dbraw/zinc/31/05/96/1046310596.db2.gz MOAZCZHOQPDHIU-VASHYATMSA-N 1 1 341.238 4.124 20 5 EIBDMO CO[C@@H](C)C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C(C)C ZINC000536659826 1046628794 /nfs/dbraw/zinc/62/87/94/1046628794.db2.gz IIOUWUGZTITKPO-AWEZNQCLSA-N 1 1 332.400 4.100 20 5 EIBDMO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1)CCC2 ZINC000536697873 1046698004 /nfs/dbraw/zinc/69/80/04/1046698004.db2.gz HTZMMTGWHZFPBP-HNNXBMFYSA-N 1 1 345.468 4.432 20 5 EIBDMO CC[N@@H+](Cc1cccc(Cl)c1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000917462082 1046889927 /nfs/dbraw/zinc/88/99/27/1046889927.db2.gz FAHMYDZOKZICDD-UHFFFAOYSA-N 1 1 344.802 4.078 20 5 EIBDMO CC[N@H+](Cc1cccc(Cl)c1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000917462082 1046889929 /nfs/dbraw/zinc/88/99/29/1046889929.db2.gz FAHMYDZOKZICDD-UHFFFAOYSA-N 1 1 344.802 4.078 20 5 EIBDMO COc1ccccc1C(C)(C)[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746666530 1046975832 /nfs/dbraw/zinc/97/58/32/1046975832.db2.gz RPKDQLUOLVCQFZ-UHFFFAOYSA-N 1 1 334.803 4.282 20 5 EIBDMO CC(C)[N@H+](Cc1cnc(C2CC2)s1)Cc1ccc([N+](=O)[O-])cc1 ZINC000154466890 1047039083 /nfs/dbraw/zinc/03/90/83/1047039083.db2.gz YLUPLKJYOIGHGB-UHFFFAOYSA-N 1 1 331.441 4.339 20 5 EIBDMO CC(C)[N@@H+](Cc1cnc(C2CC2)s1)Cc1ccc([N+](=O)[O-])cc1 ZINC000154466890 1047039102 /nfs/dbraw/zinc/03/91/02/1047039102.db2.gz YLUPLKJYOIGHGB-UHFFFAOYSA-N 1 1 331.441 4.339 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H](C)c1cccc(OC)c1 ZINC000788478404 1047198107 /nfs/dbraw/zinc/19/81/07/1047198107.db2.gz JSAWKQRFNISUQJ-ZDUSSCGKSA-N 1 1 332.375 4.326 20 5 EIBDMO COc1c(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)oc2ccccc21 ZINC000789583876 1047443532 /nfs/dbraw/zinc/44/35/32/1047443532.db2.gz JLYQVMKXTXVICI-UHFFFAOYSA-N 1 1 346.770 4.293 20 5 EIBDMO COc1ccccc1[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000609280933 1047475839 /nfs/dbraw/zinc/47/58/39/1047475839.db2.gz WXGMMIKGMMHSBS-SFHVURJKSA-N 1 1 326.396 4.331 20 5 EIBDMO C[C@H]([NH2+]Cc1c(Cl)cccc1Cl)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815572166 1048534691 /nfs/dbraw/zinc/53/46/91/1048534691.db2.gz WFAHENWFMDNHMW-VIFPVBQESA-N 1 1 340.210 4.335 20 5 EIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](Oc2ccc(Cl)cc2)C1 ZINC001170594245 1048583646 /nfs/dbraw/zinc/58/36/46/1048583646.db2.gz RZVSYCIPXREJKA-BBRMVZONSA-N 1 1 346.814 4.463 20 5 EIBDMO C[C@H](O)C[C@H]1CCCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809998356 1048599788 /nfs/dbraw/zinc/59/97/88/1048599788.db2.gz OXNGVRYKYYTNHW-GXFFZTMASA-N 1 1 347.242 4.027 20 5 EIBDMO C[C@H](O)C[C@H]1CCCC[N@H+]1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809998356 1048599803 /nfs/dbraw/zinc/59/98/03/1048599803.db2.gz OXNGVRYKYYTNHW-GXFFZTMASA-N 1 1 347.242 4.027 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@@]4(CC4(F)F)C3)o2)c1 ZINC000846106409 1048823711 /nfs/dbraw/zinc/82/37/11/1048823711.db2.gz AZJRBIVDCZBXDX-QGZVFWFLSA-N 1 1 348.349 4.476 20 5 EIBDMO CC1(C)[C@H](c2ccccc2)CC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001171266616 1049002929 /nfs/dbraw/zinc/00/29/29/1049002929.db2.gz IUFTXCIKZHACQU-IBGZPJMESA-N 1 1 340.423 4.242 20 5 EIBDMO O=[N+]([O-])c1cccc(C[NH2+]Cc2c(Cl)cccc2OC(F)F)c1 ZINC000609604267 1049190886 /nfs/dbraw/zinc/19/08/86/1049190886.db2.gz DWSKTTPZLFSVFZ-UHFFFAOYSA-N 1 1 342.729 4.139 20 5 EIBDMO C[C@@H]1C[C@H](N(C)c2ccccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000609964760 1049422289 /nfs/dbraw/zinc/42/22/89/1049422289.db2.gz CRZSZTJZKADTMR-SJLPKXTDSA-N 1 1 339.439 4.084 20 5 EIBDMO COCCCCc1ccc[nH+]c1NCc1cc([N+](=O)[O-])ccc1Cl ZINC000812807857 1049598762 /nfs/dbraw/zinc/59/87/62/1049598762.db2.gz LDJCNTRVIOXOEY-UHFFFAOYSA-N 1 1 349.818 4.224 20 5 EIBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812850822 1049610632 /nfs/dbraw/zinc/61/06/32/1049610632.db2.gz VTCZMWPHNPFREY-UGSOOPFHSA-N 1 1 348.830 4.192 20 5 EIBDMO CC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](C)[C@H](O)c1ccccc1 ZINC000812849686 1049611929 /nfs/dbraw/zinc/61/19/29/1049611929.db2.gz RFAHPSYOPDTLGW-UGSOOPFHSA-N 1 1 348.830 4.192 20 5 EIBDMO C[C@]1(Cc2cccc(F)c2)CCC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC001171425552 1049665266 /nfs/dbraw/zinc/66/52/66/1049665266.db2.gz FCGCDCVMDDDOGS-LJQANCHMSA-N 1 1 346.377 4.470 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]C1(c2cccc(Cl)c2)CC1 ZINC000179666126 1049715668 /nfs/dbraw/zinc/71/56/68/1049715668.db2.gz IJSMQYZFADCDIB-UHFFFAOYSA-N 1 1 332.787 4.036 20 5 EIBDMO CCCCC[C@H]([NH3+])c1nc(-c2ccc3ccc4cccnc4c3n2)no1 ZINC001212273540 1049771582 /nfs/dbraw/zinc/77/15/82/1049771582.db2.gz ZERDHCBTDARBFT-HNNXBMFYSA-N 1 1 347.422 4.413 20 5 EIBDMO CC(C)([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1Br ZINC000181521382 1050170833 /nfs/dbraw/zinc/17/08/33/1050170833.db2.gz PIEKGLFYBAEQNY-UHFFFAOYSA-N 1 1 349.228 4.382 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2c(Cl)cccc2C1 ZINC001173232694 1050358599 /nfs/dbraw/zinc/35/85/99/1050358599.db2.gz HDMAFBPUABBXFR-ZDUSSCGKSA-N 1 1 330.815 4.238 20 5 EIBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC001173231750 1050360272 /nfs/dbraw/zinc/36/02/72/1050360272.db2.gz CWUNUTPISLMGRX-YOEHRIQHSA-N 1 1 328.387 4.154 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cccc(OC(C)(C)C)c1 ZINC001178295431 1050430653 /nfs/dbraw/zinc/43/06/53/1050430653.db2.gz PNONLRWREVGMFC-UHFFFAOYSA-N 1 1 344.411 4.071 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(CNc2[nH]c3ccccc3[nH+]2)o1 ZINC001178677930 1050529015 /nfs/dbraw/zinc/52/90/15/1050529015.db2.gz PJYWGVQBJAYXJW-UHFFFAOYSA-N 1 1 334.335 4.343 20 5 EIBDMO CCOc1ccc([C@@H](C)[NH2+]C2(c3ccccc3F)CC2)cc1[N+](=O)[O-] ZINC000182235993 1050555556 /nfs/dbraw/zinc/55/55/56/1050555556.db2.gz VRDFOCKYKJEJMA-CYBMUJFWSA-N 1 1 344.386 4.473 20 5 EIBDMO CC(C)([NH2+]Cc1cc2cc(Cl)cnc2o1)c1ccccc1[N+](=O)[O-] ZINC001178807279 1050559104 /nfs/dbraw/zinc/55/91/04/1050559104.db2.gz YCJPOGMZNIZOIV-UHFFFAOYSA-N 1 1 345.786 4.414 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCSC3(CCCCC3)C2)cc1Cl ZINC001180057797 1050868686 /nfs/dbraw/zinc/86/86/86/1050868686.db2.gz IPCTXIUVPGSVTK-UHFFFAOYSA-N 1 1 340.876 4.500 20 5 EIBDMO COc1cccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1F ZINC000619724994 1050872750 /nfs/dbraw/zinc/87/27/50/1050872750.db2.gz CGJPSQXYCGDMDJ-UHFFFAOYSA-N 1 1 332.375 4.153 20 5 EIBDMO COc1cccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1F ZINC000619724994 1050872755 /nfs/dbraw/zinc/87/27/55/1050872755.db2.gz CGJPSQXYCGDMDJ-UHFFFAOYSA-N 1 1 332.375 4.153 20 5 EIBDMO CS[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001180071804 1050873579 /nfs/dbraw/zinc/87/35/79/1050873579.db2.gz IBFDUNNFCUQSNL-CHWSQXEVSA-N 1 1 348.390 4.330 20 5 EIBDMO Cc1[nH+]c2ccc(Br)cn2c1Nc1ccc([N+](=O)[O-])cc1 ZINC001174477644 1051019097 /nfs/dbraw/zinc/01/90/97/1051019097.db2.gz SCVFAETXCFONFL-UHFFFAOYSA-N 1 1 347.172 4.057 20 5 EIBDMO COc1cccc([C@]2(C)CC[N@@H+](Cc3ccc(C)c([N+](=O)[O-])c3)C2)c1 ZINC001174583810 1051069028 /nfs/dbraw/zinc/06/90/28/1051069028.db2.gz YLDUXAHCLLTWKX-HXUWFJFHSA-N 1 1 340.423 4.075 20 5 EIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1cc(F)cc(F)c1 ZINC001181446413 1051229179 /nfs/dbraw/zinc/22/91/79/1051229179.db2.gz YKUXFFRMIOOZEO-MLPAPPSSSA-N 1 1 332.350 4.408 20 5 EIBDMO C[C@@]1(c2ccccc2)CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC001190944794 1051308261 /nfs/dbraw/zinc/30/82/61/1051308261.db2.gz REEDGUOPMRHNCB-HXUWFJFHSA-N 1 1 340.423 4.027 20 5 EIBDMO C[C@@H](c1cccnc1)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000183720054 1051320702 /nfs/dbraw/zinc/32/07/02/1051320702.db2.gz SBFQLVOKMCONPC-AWEZNQCLSA-N 1 1 337.379 4.443 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@H](C)C[C@@H]1c1cccc(F)c1 ZINC001191244097 1051409516 /nfs/dbraw/zinc/40/95/16/1051409516.db2.gz GMWNQUJETVYDFE-FZKQIMNGSA-N 1 1 344.386 4.326 20 5 EIBDMO COc1ccccc1C[C@H](C)[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC001191338625 1051423328 /nfs/dbraw/zinc/42/33/28/1051423328.db2.gz APHKVNPZFUQOGG-ZDUSSCGKSA-N 1 1 348.830 4.320 20 5 EIBDMO Cc1noc(C[N@H+](C2CC2)C2CC(c3ccccc3C)C2)c1[N+](=O)[O-] ZINC001191331226 1051431756 /nfs/dbraw/zinc/43/17/56/1051431756.db2.gz ZKFALAAYAWXVKH-UHFFFAOYSA-N 1 1 341.411 4.110 20 5 EIBDMO Cc1noc(C[N@@H+](C2CC2)C2CC(c3ccccc3C)C2)c1[N+](=O)[O-] ZINC001191331226 1051431765 /nfs/dbraw/zinc/43/17/65/1051431765.db2.gz ZKFALAAYAWXVKH-UHFFFAOYSA-N 1 1 341.411 4.110 20 5 EIBDMO COc1ccc(C[C@H]2CC[N@@H+]2Cc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC001191494915 1051467342 /nfs/dbraw/zinc/46/73/42/1051467342.db2.gz BSQJFANXTPLNNX-MRXNPFEDSA-N 1 1 346.814 4.074 20 5 EIBDMO COc1ccc(C[C@H]2CC[N@H+]2Cc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC001191494915 1051467352 /nfs/dbraw/zinc/46/73/52/1051467352.db2.gz BSQJFANXTPLNNX-MRXNPFEDSA-N 1 1 346.814 4.074 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cccc3ncccc23)C2CC2)c1 ZINC001191682150 1051505342 /nfs/dbraw/zinc/50/53/42/1051505342.db2.gz NGCKEAUFHJAOMC-UHFFFAOYSA-N 1 1 333.391 4.308 20 5 EIBDMO COc1ccccc1[C@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC001175622991 1051678061 /nfs/dbraw/zinc/67/80/61/1051678061.db2.gz VZHBBNUVGCQNHW-HNNXBMFYSA-N 1 1 346.452 4.435 20 5 EIBDMO CC(C)(C)CC[N@@H+](CCc1ccccc1)Cc1cccnc1[N+](=O)[O-] ZINC001175677732 1051726569 /nfs/dbraw/zinc/72/65/69/1051726569.db2.gz JFJGACMHMIPRLO-UHFFFAOYSA-N 1 1 341.455 4.471 20 5 EIBDMO Cc1c(NC(=O)CC[N@@H+]2CCCCC[C@H]2C(C)C)cccc1[N+](=O)[O-] ZINC001192653321 1051781102 /nfs/dbraw/zinc/78/11/02/1051781102.db2.gz MZPLYFXKHCDUCG-KRWDZBQOSA-N 1 1 347.459 4.132 20 5 EIBDMO Cc1c(C[N@@H+]2CCC[C@@H](c3cc(C(C)C)n[nH]3)C2)cccc1[N+](=O)[O-] ZINC001175927593 1051846153 /nfs/dbraw/zinc/84/61/53/1051846153.db2.gz ZVHUEYJERQEXHN-MRXNPFEDSA-N 1 1 342.443 4.129 20 5 EIBDMO Cc1c(C[N@H+]2CCC[C@@H](c3cc(C(C)C)[nH]n3)C2)cccc1[N+](=O)[O-] ZINC001175927593 1051846157 /nfs/dbraw/zinc/84/61/57/1051846157.db2.gz ZVHUEYJERQEXHN-MRXNPFEDSA-N 1 1 342.443 4.129 20 5 EIBDMO Cc1c(C[N@@H+]2CCC[C@@H](c3cc(C(C)C)[nH]n3)C2)cccc1[N+](=O)[O-] ZINC001175927593 1051846165 /nfs/dbraw/zinc/84/61/65/1051846165.db2.gz ZVHUEYJERQEXHN-MRXNPFEDSA-N 1 1 342.443 4.129 20 5 EIBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)CC1(c2ccccc2)CC1 ZINC001193422851 1051924545 /nfs/dbraw/zinc/92/45/45/1051924545.db2.gz NWOWATXBEGQFMZ-UHFFFAOYSA-N 1 1 330.815 4.412 20 5 EIBDMO CC(C)([NH2+]Cc1cncc(Cl)c1Cl)c1ccc([N+](=O)[O-])cc1 ZINC001205291100 1051971440 /nfs/dbraw/zinc/97/14/40/1051971440.db2.gz FVPLBVKATVBCSQ-UHFFFAOYSA-N 1 1 340.210 4.322 20 5 EIBDMO CCC[C@]1(COC)CCC[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC001193872954 1052020569 /nfs/dbraw/zinc/02/05/69/1052020569.db2.gz PSIDEVUNQWZESK-MRXNPFEDSA-N 1 1 326.824 4.029 20 5 EIBDMO CCC[N@H+]1CC[C@H](CNc2c(Cl)c(Cl)ccc2[N+](=O)[O-])C1 ZINC001185028745 1052155844 /nfs/dbraw/zinc/15/58/44/1052155844.db2.gz KXUUQNIOCVBKBI-SNVBAGLBSA-N 1 1 332.231 4.045 20 5 EIBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001185037854 1052159471 /nfs/dbraw/zinc/15/94/71/1052159471.db2.gz XMSQSYFEEQPQTM-CZUORRHYSA-N 1 1 345.830 4.496 20 5 EIBDMO CC(C)[N@H+]1CCC[C@@H](CNc2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC001185088815 1052163595 /nfs/dbraw/zinc/16/35/95/1052163595.db2.gz NZZYKDCHEIHPGC-LBPRGKRZSA-N 1 1 345.365 4.146 20 5 EIBDMO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774832646 1052180668 /nfs/dbraw/zinc/18/06/68/1052180668.db2.gz KKYBUPNHDOQVDZ-KRWDZBQOSA-N 1 1 341.367 4.149 20 5 EIBDMO Cc1ccccc1[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083170119 1052842074 /nfs/dbraw/zinc/84/20/74/1052842074.db2.gz VYASSEBZPWNXBX-AWEZNQCLSA-N 1 1 337.379 4.034 20 5 EIBDMO CC[N@H+](Cc1cccc([N+](=O)[O-])c1Br)C1CC(C)(C)C1 ZINC001195083947 1053267629 /nfs/dbraw/zinc/26/76/29/1053267629.db2.gz KYCYHICLXFYDRY-UHFFFAOYSA-N 1 1 341.249 4.368 20 5 EIBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1Br)C1CC(C)(C)C1 ZINC001195083947 1053267657 /nfs/dbraw/zinc/26/76/57/1053267657.db2.gz KYCYHICLXFYDRY-UHFFFAOYSA-N 1 1 341.249 4.368 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)c1 ZINC001195298975 1053368388 /nfs/dbraw/zinc/36/83/88/1053368388.db2.gz KGGHWLNXSOSKJT-JTQLQIEISA-N 1 1 336.741 4.413 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)c1 ZINC001195298975 1053368404 /nfs/dbraw/zinc/36/84/04/1053368404.db2.gz KGGHWLNXSOSKJT-JTQLQIEISA-N 1 1 336.741 4.413 20 5 EIBDMO CC(C)n1cc2c(n1)[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)CCC2 ZINC000764937635 1053387049 /nfs/dbraw/zinc/38/70/49/1053387049.db2.gz DNPJQBCNCOLZQR-CXAGYDPISA-N 1 1 328.416 4.100 20 5 EIBDMO COCC[C@H](c1ccccc1)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000765499001 1053576743 /nfs/dbraw/zinc/57/67/43/1053576743.db2.gz FNJOUITXPJCTOZ-GOSISDBHSA-N 1 1 348.830 4.458 20 5 EIBDMO COCC[C@H](c1ccccc1)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000765499001 1053576748 /nfs/dbraw/zinc/57/67/48/1053576748.db2.gz FNJOUITXPJCTOZ-GOSISDBHSA-N 1 1 348.830 4.458 20 5 EIBDMO COc1ccc2c(c1)CC[C@@H]2[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000866305350 1053684941 /nfs/dbraw/zinc/68/49/41/1053684941.db2.gz PLTMNMNFEXAAPS-KRWDZBQOSA-N 1 1 332.787 4.034 20 5 EIBDMO C[N@H+]1CCC[C@H](CNc2ccccc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000301409064 1053871318 /nfs/dbraw/zinc/87/13/18/1053871318.db2.gz IYWFWXVVBBBEIJ-DYVFJYSZSA-N 1 1 331.441 4.151 20 5 EIBDMO C[C@@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC001197658221 1053960275 /nfs/dbraw/zinc/96/02/75/1053960275.db2.gz DXHLFUWIKWMQOO-DNVCBOLYSA-N 1 1 326.396 4.057 20 5 EIBDMO C[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC001197660391 1053961946 /nfs/dbraw/zinc/96/19/46/1053961946.db2.gz NPUSXRYMCGQCGJ-ACJLOTCBSA-N 1 1 341.367 4.086 20 5 EIBDMO Cc1csc(C[C@H]2CC[N@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC001198084064 1054068923 /nfs/dbraw/zinc/06/89/23/1054068923.db2.gz FRFUFICSFDMOJA-HUUCEWRRSA-N 1 1 345.468 4.294 20 5 EIBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)c1cncc(F)c1 ZINC000872059076 1054368179 /nfs/dbraw/zinc/36/81/79/1054368179.db2.gz ASRDWMXVEJTGPX-QWRGUYRKSA-N 1 1 335.404 4.263 20 5 EIBDMO C[C@H]([NH2+]C1(c2c(F)cccc2F)CCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000858605652 1054533634 /nfs/dbraw/zinc/53/36/34/1054533634.db2.gz YCYSRIHBYFSFJC-NSHDSACASA-N 1 1 347.365 4.185 20 5 EIBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@H]2c2ccccc2Cl)cc1 ZINC000776278261 1055150157 /nfs/dbraw/zinc/15/01/57/1055150157.db2.gz SRINXRXKZPNFEH-ROUUACIJSA-N 1 1 346.814 4.119 20 5 EIBDMO CC[C@@H](C)[C@H](C)[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000878057913 1055181470 /nfs/dbraw/zinc/18/14/70/1055181470.db2.gz RDQKAGGDKYZORV-OLZOCXBDSA-N 1 1 344.415 4.044 20 5 EIBDMO CC(C)([NH2+]Cc1cc(C(F)(F)F)co1)c1ccccc1[N+](=O)[O-] ZINC000878643570 1055363411 /nfs/dbraw/zinc/36/34/11/1055363411.db2.gz KQJYCXJUZZSUHR-UHFFFAOYSA-N 1 1 328.290 4.232 20 5 EIBDMO Cc1c([C@H](C)[NH2+]Cc2cn3cc(Cl)ccc3n2)cccc1[N+](=O)[O-] ZINC000131570266 1055432314 /nfs/dbraw/zinc/43/23/14/1055432314.db2.gz UJMKOOLOAJGJOS-LBPRGKRZSA-N 1 1 344.802 4.055 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+]Cc2ncccc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000091062124 1055511231 /nfs/dbraw/zinc/51/12/31/1055511231.db2.gz UBIXVVUPDMAPRU-NSHDSACASA-N 1 1 339.317 4.168 20 5 EIBDMO CC[C@H]([NH2+][C@H]1CCCc2cn(C(C)C)nc21)c1cccc([N+](=O)[O-])c1 ZINC000765821231 1055649887 /nfs/dbraw/zinc/64/98/87/1055649887.db2.gz NLIQQPPWALNLRR-ROUUACIJSA-N 1 1 342.443 4.491 20 5 EIBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273538507 1055921058 /nfs/dbraw/zinc/92/10/58/1055921058.db2.gz SOTFAEKNILFVLU-MJGOQNOKSA-N 1 1 344.386 4.086 20 5 EIBDMO Cc1nc(C(F)(F)F)c(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000273600623 1055991704 /nfs/dbraw/zinc/99/17/04/1055991704.db2.gz LFZPTGFDDCTHRP-QMMMGPOBSA-N 1 1 345.346 4.229 20 5 EIBDMO CC[C@@H](c1ccccc1OC)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC ZINC000554306310 1056055760 /nfs/dbraw/zinc/05/57/60/1056055760.db2.gz VZXBSVYXSFKRTD-KRWDZBQOSA-N 1 1 344.411 4.195 20 5 EIBDMO CC[C@@H](c1ccccc1OC)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC ZINC000554306310 1056055770 /nfs/dbraw/zinc/05/57/70/1056055770.db2.gz VZXBSVYXSFKRTD-KRWDZBQOSA-N 1 1 344.411 4.195 20 5 EIBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000743857873 1059170001 /nfs/dbraw/zinc/17/00/01/1059170001.db2.gz WNXVMOYCUNSKFK-CYBMUJFWSA-N 1 1 348.830 4.320 20 5 EIBDMO C[C@@H]([NH2+]Cc1ccon1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000766422684 1060343288 /nfs/dbraw/zinc/34/32/88/1060343288.db2.gz VRVHLTPBZWXLKB-LLVKDONJSA-N 1 1 329.381 4.162 20 5 EIBDMO C[N@@H+](Cc1sc2ccccc2c1Cl)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169035783 1060588797 /nfs/dbraw/zinc/58/87/97/1060588797.db2.gz CGKHEORLQIZHLI-NEPJUHHUSA-N 1 1 338.860 4.432 20 5 EIBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@H](c3ccc(Cl)c(Cl)c3)C2)C1 ZINC001169036390 1060592627 /nfs/dbraw/zinc/59/26/27/1060592627.db2.gz OANHWEMVBLKEPF-KWCYVHTRSA-N 1 1 343.254 4.228 20 5 EIBDMO CC(C)(C)Oc1ccc([C@@H]2CC[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C2)cc1 ZINC001169055819 1060609640 /nfs/dbraw/zinc/60/96/40/1060609640.db2.gz QOGQSFIXGXMLTK-CGTJXYLNSA-N 1 1 346.471 4.099 20 5 EIBDMO C[C@H]1CCCC[C@H]1[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC001169282481 1060740650 /nfs/dbraw/zinc/74/06/50/1060740650.db2.gz DFOWQIDSPKFLLZ-SMDDNHRTSA-N 1 1 341.249 4.368 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1c1ccccc1C ZINC000520401950 1032078511 /nfs/dbraw/zinc/07/85/11/1032078511.db2.gz PTZXUYXBNZQTMI-GOSISDBHSA-N 1 1 326.396 4.249 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ncoc1-c1ccccc1 ZINC000532247700 1032109757 /nfs/dbraw/zinc/10/97/57/1032109757.db2.gz DZLOSMPPFUSJOW-AWEZNQCLSA-N 1 1 337.379 4.409 20 5 EIBDMO Cc1ccccc1[C@@H]1C[N@H+](Cc2cccc([N+](=O)[O-])c2C)[C@H](C)CO1 ZINC000441436359 1032585856 /nfs/dbraw/zinc/58/58/56/1032585856.db2.gz GQTWKQZNIOIFEW-QRWLVFNGSA-N 1 1 340.423 4.174 20 5 EIBDMO Cc1ccccc1[C@@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2C)[C@H](C)CO1 ZINC000441436359 1032585870 /nfs/dbraw/zinc/58/58/70/1032585870.db2.gz GQTWKQZNIOIFEW-QRWLVFNGSA-N 1 1 340.423 4.174 20 5 EIBDMO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1OC)c1ccc(F)cc1F ZINC000430208308 1019336301 /nfs/dbraw/zinc/33/63/01/1019336301.db2.gz UKNKZILMUYIWPY-MRXNPFEDSA-N 1 1 336.338 4.123 20 5 EIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)c1cc2cccc(F)c2o1 ZINC000430238264 1019560785 /nfs/dbraw/zinc/56/07/85/1019560785.db2.gz KPMTUDNUWBNJAV-LLVKDONJSA-N 1 1 344.342 4.340 20 5 EIBDMO CCc1ccc([C@H](COC)[NH2+][C@@H](CC)c2cccc([N+](=O)[O-])c2)o1 ZINC000165286803 1020040953 /nfs/dbraw/zinc/04/09/53/1020040953.db2.gz GNCWBTJEUCJFDU-IRXDYDNUSA-N 1 1 332.400 4.179 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+](Cc3cccc(F)c3)C3CC3)nc2c1 ZINC000083168877 1021019700 /nfs/dbraw/zinc/01/97/00/1021019700.db2.gz ZWIYMGFHVABMOJ-UHFFFAOYSA-N 1 1 341.342 4.040 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+](Cc3cccc(F)c3)C3CC3)nc2c1 ZINC000083168877 1021019704 /nfs/dbraw/zinc/01/97/04/1021019704.db2.gz ZWIYMGFHVABMOJ-UHFFFAOYSA-N 1 1 341.342 4.040 20 5 EIBDMO CCC[C@@]1(C)CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000464843252 1021153618 /nfs/dbraw/zinc/15/36/18/1021153618.db2.gz RULSDUGUFJVZRX-SFHVURJKSA-N 1 1 344.415 4.047 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1CCC(C[NH+]2CCCCCC2)CC1 ZINC000610367495 1021542621 /nfs/dbraw/zinc/54/26/21/1021542621.db2.gz KQCOIFVLARQLKO-QGZVFWFLSA-N 1 1 345.487 4.244 20 5 EIBDMO C[C@@]1(c2ccccc2)CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC001167368106 1021766819 /nfs/dbraw/zinc/76/68/19/1021766819.db2.gz VMJJTXMRZPFDEQ-HXUWFJFHSA-N 1 1 340.423 4.027 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000464856894 1021813394 /nfs/dbraw/zinc/81/33/94/1021813394.db2.gz SKYMFWAUXGJLSI-CZUORRHYSA-N 1 1 330.384 4.170 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000464856894 1021813398 /nfs/dbraw/zinc/81/33/98/1021813398.db2.gz SKYMFWAUXGJLSI-CZUORRHYSA-N 1 1 330.384 4.170 20 5 EIBDMO C[C@@H](NCC[C@H](C)[N@@H+](C)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000379635501 1021846053 /nfs/dbraw/zinc/84/60/53/1021846053.db2.gz WFWVNABPEOQOKJ-DLBZAZTESA-N 1 1 341.455 4.156 20 5 EIBDMO C[C@@H](NCC[C@@H](C)[N@@H+](C)Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000379624337 1021846771 /nfs/dbraw/zinc/84/67/71/1021846771.db2.gz JNFDVRMFDKRYKF-IAGOWNOFSA-N 1 1 341.455 4.156 20 5 EIBDMO Cc1[nH+]ccn1Cc1ccc(Nc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC001210953634 1021885617 /nfs/dbraw/zinc/88/56/17/1021885617.db2.gz MAQWVXQXUJSPFJ-UHFFFAOYSA-N 1 1 326.331 4.031 20 5 EIBDMO C[C@@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1nccn1-c1ccccc1 ZINC000582370693 1021934680 /nfs/dbraw/zinc/93/46/80/1021934680.db2.gz XKRIJRGNEWWYMX-KDOFPFPSSA-N 1 1 348.406 4.119 20 5 EIBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1cc(F)c(Cl)cc1F ZINC000579610634 1021958818 /nfs/dbraw/zinc/95/88/18/1021958818.db2.gz ALOGENDOQWFILK-HNNXBMFYSA-N 1 1 338.741 4.304 20 5 EIBDMO CCOc1ccc(C(C)=O)cc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180420459 1022647927 /nfs/dbraw/zinc/64/79/27/1022647927.db2.gz UQZWKPWYUJWEEG-ZDUSSCGKSA-N 1 1 342.395 4.047 20 5 EIBDMO CCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1C[C@@H](OCC)C1(C)C ZINC001167443293 1022808950 /nfs/dbraw/zinc/80/89/50/1022808950.db2.gz RMDQIBORKPLOPS-ZWKOTPCHSA-N 1 1 334.460 4.053 20 5 EIBDMO C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1cccc(Cl)c1 ZINC000181415833 1023056787 /nfs/dbraw/zinc/05/67/87/1023056787.db2.gz TUGCIASITHXDGF-SNVBAGLBSA-N 1 1 331.759 4.240 20 5 EIBDMO C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])s2)CC[N@H+]1Cc1ccccc1 ZINC000610573519 1023217767 /nfs/dbraw/zinc/21/77/67/1023217767.db2.gz NVHGEZBRZXKCPC-ZFWWWQNUSA-N 1 1 331.441 4.121 20 5 EIBDMO C[C@]1([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCOc2ccccc21 ZINC000933371887 1023599084 /nfs/dbraw/zinc/59/90/84/1023599084.db2.gz SYAIIGKRUCWEGR-KRWDZBQOSA-N 1 1 332.787 4.036 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](Cc3ccccc3)C2)c(Cl)c1 ZINC001167482335 1023695799 /nfs/dbraw/zinc/69/57/99/1023695799.db2.gz JHWPNCVJWRZAMQ-HNNXBMFYSA-N 1 1 330.815 4.313 20 5 EIBDMO C[N@@H+](CCC1CCCCC1)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000101566027 1023758778 /nfs/dbraw/zinc/75/87/78/1023758778.db2.gz RZPKYGUPALXCNO-UHFFFAOYSA-N 1 1 344.415 4.047 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cnc(C3CCC3)s2)c(Cl)c1 ZINC000341541568 1023848311 /nfs/dbraw/zinc/84/83/11/1023848311.db2.gz WPGBIYNLRBKWBZ-UHFFFAOYSA-N 1 1 337.832 4.262 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC001167765150 1023855226 /nfs/dbraw/zinc/85/52/26/1023855226.db2.gz CDNACDQUOWMFID-QGZVFWFLSA-N 1 1 345.830 4.325 20 5 EIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC001167765150 1023855230 /nfs/dbraw/zinc/85/52/30/1023855230.db2.gz CDNACDQUOWMFID-QGZVFWFLSA-N 1 1 345.830 4.325 20 5 EIBDMO COCC1=CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000187621881 1023901723 /nfs/dbraw/zinc/90/17/23/1023901723.db2.gz MPNHGLKNVONHLD-UHFFFAOYSA-N 1 1 344.436 4.102 20 5 EIBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H]1CCCc2ccccc21 ZINC000610580825 1024108675 /nfs/dbraw/zinc/10/86/75/1024108675.db2.gz NUNVGFKICNPFBW-QGZVFWFLSA-N 1 1 337.379 4.245 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCO[C@H]3CCC[C@@H]32)s1 ZINC000510685121 1024234979 /nfs/dbraw/zinc/23/49/79/1024234979.db2.gz UCGRGWOYENGMPK-IRXDYDNUSA-N 1 1 344.436 4.077 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCO[C@H]3CCC[C@@H]32)s1 ZINC000510685121 1024234992 /nfs/dbraw/zinc/23/49/92/1024234992.db2.gz UCGRGWOYENGMPK-IRXDYDNUSA-N 1 1 344.436 4.077 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1nccc2ccccc21 ZINC000567284594 1024351529 /nfs/dbraw/zinc/35/15/29/1024351529.db2.gz WTQGWSRTCXBDJZ-CYBMUJFWSA-N 1 1 337.379 4.002 20 5 EIBDMO CCOc1cc(C[NH2+][C@@H](C)c2cccc(F)c2F)ccc1[N+](=O)[O-] ZINC000276840928 1024499336 /nfs/dbraw/zinc/49/93/36/1024499336.db2.gz CGOFSCUUAUHSNQ-NSHDSACASA-N 1 1 336.338 4.123 20 5 EIBDMO CCc1ccc([C@@H](COC)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)o1 ZINC000165261309 1025181565 /nfs/dbraw/zinc/18/15/65/1025181565.db2.gz XXJQSQLZMRXCHM-XJKSGUPXSA-N 1 1 332.400 4.097 20 5 EIBDMO Cc1ccc(Br)cc1C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000190296886 1025447846 /nfs/dbraw/zinc/44/78/46/1025447846.db2.gz ZTQPLEIHUGGBRH-UHFFFAOYSA-N 1 1 341.230 4.017 20 5 EIBDMO CO[C@@H](C[N@@H+](C)CCc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000511068308 1026102491 /nfs/dbraw/zinc/10/24/91/1026102491.db2.gz ZJENGMYDZGQPNI-SFHVURJKSA-N 1 1 348.830 4.110 20 5 EIBDMO COc1cc(F)c([C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000266502839 1026453580 /nfs/dbraw/zinc/45/35/80/1026453580.db2.gz VWDNXCKITRPDKF-NEPJUHHUSA-N 1 1 348.374 4.163 20 5 EIBDMO COc1ccc2ccccc2c1C[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000507132513 1026656370 /nfs/dbraw/zinc/65/63/70/1026656370.db2.gz SSTXTTRFJYHDRD-UHFFFAOYSA-N 1 1 336.391 4.389 20 5 EIBDMO COc1ccc2ccccc2c1C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000507132513 1026656375 /nfs/dbraw/zinc/65/63/75/1026656375.db2.gz SSTXTTRFJYHDRD-UHFFFAOYSA-N 1 1 336.391 4.389 20 5 EIBDMO C[N@H+](Cc1ccc(F)c(C(F)(F)F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000507152533 1026673933 /nfs/dbraw/zinc/67/39/33/1026673933.db2.gz VRUMKYJGBHLOOQ-UHFFFAOYSA-N 1 1 342.292 4.385 20 5 EIBDMO C[N@@H+](Cc1ccc(F)c(C(F)(F)F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000507152533 1026673941 /nfs/dbraw/zinc/67/39/41/1026673941.db2.gz VRUMKYJGBHLOOQ-UHFFFAOYSA-N 1 1 342.292 4.385 20 5 EIBDMO COc1ccc2cc(C[N@@H+](C)Cc3cccc([N+](=O)[O-])c3)ccc2c1 ZINC000015370241 1026710560 /nfs/dbraw/zinc/71/05/60/1026710560.db2.gz UQZZYRAWDUCLBY-UHFFFAOYSA-N 1 1 336.391 4.389 20 5 EIBDMO C[C@@H]([NH2+]CC(C)(C)N[C@@H](C)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000467869731 1026736915 /nfs/dbraw/zinc/73/69/15/1026736915.db2.gz VTRPIFVXDAKBCV-CVEARBPZSA-N 1 1 341.455 4.375 20 5 EIBDMO C[C@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000441335327 1027451367 /nfs/dbraw/zinc/45/13/67/1027451367.db2.gz FOADINQQQMURIR-KPZWWZAWSA-N 1 1 332.350 4.456 20 5 EIBDMO C[C@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000441335327 1027451371 /nfs/dbraw/zinc/45/13/71/1027451371.db2.gz FOADINQQQMURIR-KPZWWZAWSA-N 1 1 332.350 4.456 20 5 EIBDMO Cc1c(C[N@@H+]2CCSC[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000522468695 1027454248 /nfs/dbraw/zinc/45/42/48/1027454248.db2.gz RUMGSCMHWOPXAM-GOSISDBHSA-N 1 1 328.437 4.193 20 5 EIBDMO Cc1c(C[N@H+]2CCSC[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000522468695 1027454252 /nfs/dbraw/zinc/45/42/52/1027454252.db2.gz RUMGSCMHWOPXAM-GOSISDBHSA-N 1 1 328.437 4.193 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H](C)C[C@@H]1c1cccc(F)c1 ZINC000441325900 1027461405 /nfs/dbraw/zinc/46/14/05/1027461405.db2.gz UKVJDOBPDLIDKC-SCLBCKFNSA-N 1 1 344.386 4.326 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](C)C[C@@H]1c1cccc(F)c1 ZINC000441325900 1027461416 /nfs/dbraw/zinc/46/14/16/1027461416.db2.gz UKVJDOBPDLIDKC-SCLBCKFNSA-N 1 1 344.386 4.326 20 5 EIBDMO CC(C)(C)c1ccncc1C[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000894908063 1027503348 /nfs/dbraw/zinc/50/33/48/1027503348.db2.gz ZAPKYSPVDDNRRO-UHFFFAOYSA-N 1 1 333.819 4.231 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[NH2+][C@@H](c3cccs3)C3CC3)nc2c1 ZINC000612457944 1027560798 /nfs/dbraw/zinc/56/07/98/1027560798.db2.gz DIGDGEFKGLHREW-MRXNPFEDSA-N 1 1 329.381 4.038 20 5 EIBDMO Cc1ccc(C)c([C@H](C)[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444588881 1027877262 /nfs/dbraw/zinc/87/72/62/1027877262.db2.gz HAODVFJBXSOTQC-AWEZNQCLSA-N 1 1 338.411 4.281 20 5 EIBDMO Cc1ccc(C)c([C@H](C)[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444588881 1027877267 /nfs/dbraw/zinc/87/72/67/1027877267.db2.gz HAODVFJBXSOTQC-AWEZNQCLSA-N 1 1 338.411 4.281 20 5 EIBDMO CC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H]1CCCC[C@H]1C ZINC000444674944 1027955334 /nfs/dbraw/zinc/95/53/34/1027955334.db2.gz KZNCXFNLAAKULX-CZUORRHYSA-N 1 1 344.415 4.045 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCC[C@H]3/C=C\c3ccccc3)nc2c1 ZINC000444676908 1027956857 /nfs/dbraw/zinc/95/68/57/1027956857.db2.gz RYLZEJFGNACIFY-QWGSZXSUSA-N 1 1 348.406 4.149 20 5 EIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@H]3/C=C\c3ccccc3)nc2c1 ZINC000444676908 1027956876 /nfs/dbraw/zinc/95/68/76/1027956876.db2.gz RYLZEJFGNACIFY-QWGSZXSUSA-N 1 1 348.406 4.149 20 5 EIBDMO C[N@@H+](CCCOc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000522536521 1027979807 /nfs/dbraw/zinc/97/98/07/1027979807.db2.gz UDVROGUVNQIYST-UHFFFAOYSA-N 1 1 334.803 4.149 20 5 EIBDMO CC1CCC([N@H+](Cc2ccc([N+](=O)[O-])cc2)C[C@H]2CCCO2)CC1 ZINC000441447103 1027998980 /nfs/dbraw/zinc/99/89/80/1027998980.db2.gz MJUNWNLQFRDBDQ-GXOAENINSA-N 1 1 332.444 4.155 20 5 EIBDMO CC1CCC([N@H+](Cc2ccc([N+](=O)[O-])cc2)C[C@@H]2CCCO2)CC1 ZINC000441447105 1028000537 /nfs/dbraw/zinc/00/05/37/1028000537.db2.gz MJUNWNLQFRDBDQ-KVWWFHCMSA-N 1 1 332.444 4.155 20 5 EIBDMO Cc1ccccc1[C@@H]1C[C@H](C)[N@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000523442074 1028119321 /nfs/dbraw/zinc/11/93/21/1028119321.db2.gz KDEPVSHEBMZMJP-DLBZAZTESA-N 1 1 340.423 4.160 20 5 EIBDMO CC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@H](C)c1cccc(OC)c1 ZINC000052706388 1029426351 /nfs/dbraw/zinc/42/63/51/1029426351.db2.gz XLASHQUMAIRMOZ-CQSZACIVSA-N 1 1 344.411 4.195 20 5 EIBDMO CCc1ccc([C@H]([NH2+]CCOC(C)(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544381177 1029458375 /nfs/dbraw/zinc/45/83/75/1029458375.db2.gz ZGVZNXWZZPBLSL-GOSISDBHSA-N 1 1 346.427 4.244 20 5 EIBDMO C[C@@H](C1CCCCC1)[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000447383076 1030048598 /nfs/dbraw/zinc/04/85/98/1030048598.db2.gz JOLDDQSBUKSBDV-ZDUSSCGKSA-N 1 1 344.415 4.045 20 5 EIBDMO COc1ccc(C[N@@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)cc1[N+](=O)[O-] ZINC000191664499 1031097781 /nfs/dbraw/zinc/09/77/81/1031097781.db2.gz APTKQIOHLDEMFU-AWEZNQCLSA-N 1 1 346.349 4.014 20 5 EIBDMO COc1ccc(C[N@H+]2CC[C@H](C(F)(F)F)C(C)(C)C2)cc1[N+](=O)[O-] ZINC000191664499 1031097800 /nfs/dbraw/zinc/09/78/00/1031097800.db2.gz APTKQIOHLDEMFU-AWEZNQCLSA-N 1 1 346.349 4.014 20 5 EIBDMO CCCCOc1ncccc1C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000532462938 1031130582 /nfs/dbraw/zinc/13/05/82/1031130582.db2.gz ARTGCMMIBFLKAR-HNNXBMFYSA-N 1 1 343.427 4.328 20 5 EIBDMO CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000179530327 1031196413 /nfs/dbraw/zinc/19/64/13/1031196413.db2.gz IMDYXLPVWRRTPV-CYBMUJFWSA-N 1 1 332.375 4.372 20 5 EIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]1c1cccc(C)n1 ZINC000159707824 1031471291 /nfs/dbraw/zinc/47/12/91/1031471291.db2.gz WWKQMORHKOOPTF-SFHVURJKSA-N 1 1 341.411 4.034 20 5 EIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1c1cccc(C)n1 ZINC000159707824 1031471306 /nfs/dbraw/zinc/47/13/06/1031471306.db2.gz WWKQMORHKOOPTF-SFHVURJKSA-N 1 1 341.411 4.034 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCCc3c(F)cc(F)cc32)c(F)c1 ZINC000449351446 1031650565 /nfs/dbraw/zinc/65/05/65/1031650565.db2.gz PLYDPKGGXSYTHL-QGZVFWFLSA-N 1 1 336.313 4.179 20 5 EIBDMO C[C@@H]1C[C@H](C(F)(F)F)CC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000449461152 1031779107 /nfs/dbraw/zinc/77/91/07/1031779107.db2.gz OPXPJAARBXVYJX-UDGJJRABSA-N 1 1 328.334 4.271 20 5 EIBDMO Cc1nc(C)c(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000449494317 1031803677 /nfs/dbraw/zinc/80/36/77/1031803677.db2.gz ABZONKVMFVGYAP-OAHLLOKOSA-N 1 1 331.441 4.048 20 5 EIBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@H]1C ZINC000449505623 1031814213 /nfs/dbraw/zinc/81/42/13/1031814213.db2.gz RIDOPOUFCBCPDI-CXAGYDPISA-N 1 1 346.452 4.180 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1cc(F)c(Cl)cc1F ZINC000433191601 1034014226 /nfs/dbraw/zinc/01/42/26/1034014226.db2.gz VPFNEDSUBBVINO-UHFFFAOYSA-N 1 1 326.730 4.125 20 5 EIBDMO C[N@H+]1CC[C@@H](Nc2nc3ccccc3cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000473518907 1034676090 /nfs/dbraw/zinc/67/60/90/1034676090.db2.gz MYHSLWFUFZJFLR-IEBWSBKVSA-N 1 1 348.406 4.000 20 5 EIBDMO CCc1nccn1[C@H]1CCC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000182759780 1034988454 /nfs/dbraw/zinc/98/84/54/1034988454.db2.gz IKHWHUBLGMWKLH-RDJZCZTQSA-N 1 1 342.443 4.060 20 5 EIBDMO CN(Cc1ccccc1[N+](=O)[O-])c1cc[nH+]c2ccc(Cl)cc21 ZINC000513605091 1035048100 /nfs/dbraw/zinc/04/81/00/1035048100.db2.gz ZJAAYMGTDTTZJH-UHFFFAOYSA-N 1 1 327.771 4.433 20 5 EIBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])Cc1ccccc1N1CCCCC1 ZINC000015574061 1035337405 /nfs/dbraw/zinc/33/74/05/1035337405.db2.gz FTROPNZKZKUHOA-UHFFFAOYSA-N 1 1 339.439 4.217 20 5 EIBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])Cc1ccccc1N1CCCCC1 ZINC000015574061 1035337409 /nfs/dbraw/zinc/33/74/09/1035337409.db2.gz FTROPNZKZKUHOA-UHFFFAOYSA-N 1 1 339.439 4.217 20 5 EIBDMO CC[C@H](N[C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000183195491 1035337600 /nfs/dbraw/zinc/33/76/00/1035337600.db2.gz IGYKZUOQMAWHLY-VPWXQRGCSA-N 1 1 345.487 4.289 20 5 EIBDMO CC[C@H](N[C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000183195491 1035337603 /nfs/dbraw/zinc/33/76/03/1035337603.db2.gz IGYKZUOQMAWHLY-VPWXQRGCSA-N 1 1 345.487 4.289 20 5 EIBDMO COc1ccc(F)cc1[C@@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595014843 1035508374 /nfs/dbraw/zinc/50/83/74/1035508374.db2.gz UQAHTGZBUCYYBM-VXGBXAGGSA-N 1 1 348.374 4.163 20 5 EIBDMO C[C@H]([NH2+]Cc1cccc(F)c1OC(F)F)c1cccc([N+](=O)[O-])c1 ZINC000595414970 1035672217 /nfs/dbraw/zinc/67/22/17/1035672217.db2.gz PAWCABVVPRCVAY-JTQLQIEISA-N 1 1 340.301 4.186 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H]([C@@H]2CCCCO2)C1 ZINC000595789233 1035794256 /nfs/dbraw/zinc/79/42/56/1035794256.db2.gz PVRVJJQIOOMAKW-BXWFABGCSA-N 1 1 332.444 4.245 20 5 EIBDMO COc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC000491091122 1035806952 /nfs/dbraw/zinc/80/69/52/1035806952.db2.gz NWFKMVIHIMYPKH-SFHVURJKSA-N 1 1 330.359 4.080 20 5 EIBDMO COc1cccc([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC000491091122 1035806957 /nfs/dbraw/zinc/80/69/57/1035806957.db2.gz NWFKMVIHIMYPKH-SFHVURJKSA-N 1 1 330.359 4.080 20 5 EIBDMO CCOc1cc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000420939746 1035881939 /nfs/dbraw/zinc/88/19/39/1035881939.db2.gz CFTFBMISONKXGB-ZDUSSCGKSA-N 1 1 346.349 4.158 20 5 EIBDMO COc1cc(C[N@H+]2CCCCC[C@H]2c2ccco2)ccc1[N+](=O)[O-] ZINC000485570392 1036031017 /nfs/dbraw/zinc/03/10/17/1036031017.db2.gz PLKYCOXUTSFHRP-HNNXBMFYSA-N 1 1 330.384 4.314 20 5 EIBDMO C[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])s2)[C@@H]1c1cccs1 ZINC000078338317 1036074559 /nfs/dbraw/zinc/07/45/59/1036074559.db2.gz QJBGYZQFGUKPKZ-IAQYHMDHSA-N 1 1 337.470 4.213 20 5 EIBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)CC1=CCSC1 ZINC000597243163 1036168785 /nfs/dbraw/zinc/16/87/85/1036168785.db2.gz GDDKCYVRYHFLIY-UHFFFAOYSA-N 1 1 346.477 4.428 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(F)cc(Cl)c2)c(Cl)c1 ZINC000485717031 1036202653 /nfs/dbraw/zinc/20/26/53/1036202653.db2.gz NEWGTZGBPZXVAB-UHFFFAOYSA-N 1 1 329.158 4.331 20 5 EIBDMO COc1cc(C[N@@H+](C)[C@H](C)c2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000485736120 1036226617 /nfs/dbraw/zinc/22/66/17/1036226617.db2.gz HDAVHYRCYRKJRF-GFCCVEGCSA-N 1 1 334.803 4.450 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@@H](c2ccccc2)O[C@@H](C)C1 ZINC000485825236 1036305097 /nfs/dbraw/zinc/30/50/97/1036305097.db2.gz MQVTWIPAOYFNBE-FTRWYGJKSA-N 1 1 340.423 4.426 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@H](c2ccccc2)O[C@@H](C)C1 ZINC000485825236 1036305112 /nfs/dbraw/zinc/30/51/12/1036305112.db2.gz MQVTWIPAOYFNBE-FTRWYGJKSA-N 1 1 340.423 4.426 20 5 EIBDMO COc1ccc2c(c1)C[N@H+]([C@H](C)c1cc([N+](=O)[O-])ccc1C)CC2 ZINC000485825275 1036309957 /nfs/dbraw/zinc/30/99/57/1036309957.db2.gz MUMHDEFXPABDQT-CQSZACIVSA-N 1 1 326.396 4.031 20 5 EIBDMO COc1ccc2c(c1)C[N@@H+]([C@H](C)c1cc([N+](=O)[O-])ccc1C)CC2 ZINC000485825275 1036309979 /nfs/dbraw/zinc/30/99/79/1036309979.db2.gz MUMHDEFXPABDQT-CQSZACIVSA-N 1 1 326.396 4.031 20 5 EIBDMO CC[C@H]1C[C@]1([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1cccc(C)c1 ZINC000502564759 1036359596 /nfs/dbraw/zinc/35/95/96/1036359596.db2.gz ILMPNHKVLIXCGC-IFXJQAMLSA-N 1 1 328.387 4.457 20 5 EIBDMO CC(C)c1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000602520105 1036477435 /nfs/dbraw/zinc/47/74/35/1036477435.db2.gz DKLWYLRYICMGEF-UHFFFAOYSA-N 1 1 325.368 4.149 20 5 EIBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1Br ZINC000034996166 1036504807 /nfs/dbraw/zinc/50/48/07/1036504807.db2.gz YFSIEGBZOATJMP-NSHDSACASA-N 1 1 335.201 4.208 20 5 EIBDMO Cc1noc(C[NH2+][C@H](c2ccc(F)cc2)C2CCCCC2)c1[N+](=O)[O-] ZINC000602966365 1036691619 /nfs/dbraw/zinc/69/16/19/1036691619.db2.gz BWKDQTCZVLBTGP-KRWDZBQOSA-N 1 1 347.390 4.442 20 5 EIBDMO CC(C)c1ccc(CNCC(C)(C)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000061015345 1036769271 /nfs/dbraw/zinc/76/92/71/1036769271.db2.gz JQTAPBZBXJCJJA-UHFFFAOYSA-N 1 1 333.476 4.072 20 5 EIBDMO CCCCC[C@@H]1CCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000486779161 1036851425 /nfs/dbraw/zinc/85/14/25/1036851425.db2.gz NIZUMCKIQMKPRX-OAHLLOKOSA-N 1 1 344.415 4.190 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2ccccc2F)cc(C(F)(F)F)c1 ZINC000487164821 1037026570 /nfs/dbraw/zinc/02/65/70/1037026570.db2.gz CKRYCUZFOUQXTE-UHFFFAOYSA-N 1 1 328.265 4.043 20 5 EIBDMO COc1ccc(C[N@@H+](C)CCCCc2ccccc2)cc1[N+](=O)[O-] ZINC000603855001 1037050130 /nfs/dbraw/zinc/05/01/30/1037050130.db2.gz WQUDPJNMJHRAFD-UHFFFAOYSA-N 1 1 328.412 4.058 20 5 EIBDMO C[C@H]1CCCC[N@H+]1CCCCNc1ccc([N+](=O)[O-])cc1Cl ZINC000603859503 1037052556 /nfs/dbraw/zinc/05/25/56/1037052556.db2.gz FKAVRUHKTYXECD-ZDUSSCGKSA-N 1 1 325.840 4.315 20 5 EIBDMO Cc1noc(C[NH2+]C(C)(C)c2ccc3ccccc3c2)c1[N+](=O)[O-] ZINC000599672143 1037115444 /nfs/dbraw/zinc/11/54/44/1037115444.db2.gz BEIWLTQYAYUSHJ-UHFFFAOYSA-N 1 1 325.368 4.069 20 5 EIBDMO Cc1c(C[NH2+]C2(c3c(F)cccc3F)CCC2)cccc1[N+](=O)[O-] ZINC000599695799 1037123808 /nfs/dbraw/zinc/12/38/08/1037123808.db2.gz MBIVQVNEIKSOPQ-UHFFFAOYSA-N 1 1 332.350 4.350 20 5 EIBDMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000604012570 1037148320 /nfs/dbraw/zinc/14/83/20/1037148320.db2.gz RBGRFVRKKKYSPL-AWEZNQCLSA-N 1 1 332.375 4.196 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH+]3CC(CC(F)(F)F)C3)o2)c1 ZINC000590969217 1037217370 /nfs/dbraw/zinc/21/73/70/1037217370.db2.gz OZVBBVCXPZSLGR-UHFFFAOYSA-N 1 1 340.301 4.239 20 5 EIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(F)cc3cccnc32)c(Cl)c1 ZINC000183798984 1037248198 /nfs/dbraw/zinc/24/81/98/1037248198.db2.gz KCKGMHDHIDBOAC-UHFFFAOYSA-N 1 1 345.761 4.225 20 5 EIBDMO COc1ccc2oc(C[NH2+]Cc3ccc([N+](=O)[O-])cc3Cl)cc2c1 ZINC000183805992 1037273200 /nfs/dbraw/zinc/27/32/00/1037273200.db2.gz IFGYYZYHVFUHQL-UHFFFAOYSA-N 1 1 346.770 4.293 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cc3ccc(F)cc3[nH]2)C2CC2)c1 ZINC000488353719 1037540473 /nfs/dbraw/zinc/54/04/73/1037540473.db2.gz KFWXSWXSQXTLTG-UHFFFAOYSA-N 1 1 339.370 4.380 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cc3ccc(F)cc3[nH]2)C2CC2)c1 ZINC000488353719 1037540519 /nfs/dbraw/zinc/54/05/19/1037540519.db2.gz KFWXSWXSQXTLTG-UHFFFAOYSA-N 1 1 339.370 4.380 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1cc2ccc(F)cc2[nH]1)C1CC1 ZINC000488360965 1037548012 /nfs/dbraw/zinc/54/80/12/1037548012.db2.gz VZXSJFYMCJNWKD-UHFFFAOYSA-N 1 1 339.370 4.380 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cc2ccc(F)cc2[nH]1)C1CC1 ZINC000488360965 1037548021 /nfs/dbraw/zinc/54/80/21/1037548021.db2.gz VZXSJFYMCJNWKD-UHFFFAOYSA-N 1 1 339.370 4.380 20 5 EIBDMO CC(C)[N@@H+](CCc1noc2ccccc21)Cc1ccc([N+](=O)[O-])cc1 ZINC000593949212 1037926924 /nfs/dbraw/zinc/92/69/24/1037926924.db2.gz ZDYXVVOQJYTXRE-UHFFFAOYSA-N 1 1 339.395 4.189 20 5 EIBDMO CC[C@@H]([NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-])c1ccccc1F ZINC000594019390 1038210530 /nfs/dbraw/zinc/21/05/30/1038210530.db2.gz JLDYSBGEHBUCGE-OAHLLOKOSA-N 1 1 336.338 4.123 20 5 EIBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1(C)CCCC1 ZINC000490195128 1038382555 /nfs/dbraw/zinc/38/25/55/1038382555.db2.gz RUWFMRONGBJHAX-UHFFFAOYSA-N 1 1 329.400 4.057 20 5 EIBDMO C[C@@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1ccccc1[N+](=O)[O-] ZINC000594722437 1038393477 /nfs/dbraw/zinc/39/34/77/1038393477.db2.gz PWWROGBPKDZWMW-GFCCVEGCSA-N 1 1 330.359 4.126 20 5 EIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C1CC1)C1CCCCC1 ZINC000063497944 1038394027 /nfs/dbraw/zinc/39/40/27/1038394027.db2.gz JYBLZQBNJNIPJT-UHFFFAOYSA-N 1 1 345.443 4.029 20 5 EIBDMO C[C@@H]1C[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)CC(C)(C)C1 ZINC001168423667 1038484103 /nfs/dbraw/zinc/48/41/03/1038484103.db2.gz ONXUHXOJWDZEQU-NSHDSACASA-N 1 1 341.249 4.225 20 5 EIBDMO C[C@@H]1C[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)CC(C)(C)C1 ZINC001168423667 1038484280 /nfs/dbraw/zinc/48/42/80/1038484280.db2.gz ONXUHXOJWDZEQU-NSHDSACASA-N 1 1 341.249 4.225 20 5 EIBDMO COc1ccc(Cl)cc1C(C)(C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000424199896 1038736830 /nfs/dbraw/zinc/73/68/30/1038736830.db2.gz LFEQAFNETKBOEY-UHFFFAOYSA-N 1 1 340.832 4.343 20 5 EIBDMO CC[C@@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000534122741 1039121241 /nfs/dbraw/zinc/12/12/41/1039121241.db2.gz WOQAKDMVJRMQGB-CQSZACIVSA-N 1 1 329.400 4.262 20 5 EIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+](CCO)C2CCCC2)s1 ZINC000505283462 1039191535 /nfs/dbraw/zinc/19/15/35/1039191535.db2.gz NQUAGFVQMQYINR-UHFFFAOYSA-N 1 1 346.452 4.060 20 5 EIBDMO CC[C@@H]1CCCC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000505362520 1039248929 /nfs/dbraw/zinc/24/89/29/1039248929.db2.gz PWXTXDOMRPBFTE-OAHLLOKOSA-N 1 1 331.441 4.483 20 5 EIBDMO CCC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CCCc2cccnc21 ZINC000481416052 1039404282 /nfs/dbraw/zinc/40/42/82/1039404282.db2.gz GYKNRAAWCKWUST-SFHVURJKSA-N 1 1 325.412 4.279 20 5 EIBDMO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000534853573 1039813710 /nfs/dbraw/zinc/81/37/10/1039813710.db2.gz FZLGXJJTABUBPM-AWEZNQCLSA-N 1 1 349.390 4.197 20 5 EIBDMO C[C@H]1Cc2ccccc2C[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000534853573 1039813714 /nfs/dbraw/zinc/81/37/14/1039813714.db2.gz FZLGXJJTABUBPM-AWEZNQCLSA-N 1 1 349.390 4.197 20 5 EIBDMO C[C@@]12CC[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C[C@@H]1C2(F)F ZINC000430103478 1039845059 /nfs/dbraw/zinc/84/50/59/1039845059.db2.gz KBKPEJZCNQMCGZ-DLBZAZTESA-N 1 1 348.349 4.332 20 5 EIBDMO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccc(OC)c([N+](=O)[O-])c2)s1 ZINC000122137400 1039864333 /nfs/dbraw/zinc/86/43/33/1039864333.db2.gz PHUNFUXRDNZVJS-GFCCVEGCSA-N 1 1 349.456 4.124 20 5 EIBDMO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ccc(OC)c([N+](=O)[O-])c2)s1 ZINC000122137400 1039864335 /nfs/dbraw/zinc/86/43/35/1039864335.db2.gz PHUNFUXRDNZVJS-GFCCVEGCSA-N 1 1 349.456 4.124 20 5 EIBDMO CCc1nc2c(s1)[C@H]([N@H+](C)Cc1ccccc1[N+](=O)[O-])CCC2 ZINC000152615011 1040096587 /nfs/dbraw/zinc/09/65/87/1040096587.db2.gz NWZRUHWZOPOTJQ-OAHLLOKOSA-N 1 1 331.441 4.123 20 5 EIBDMO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1ccccc1[N+](=O)[O-])CCC2 ZINC000152615011 1040096607 /nfs/dbraw/zinc/09/66/07/1040096607.db2.gz NWZRUHWZOPOTJQ-OAHLLOKOSA-N 1 1 331.441 4.123 20 5 EIBDMO Cc1ccccc1[C@@H]1CCC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482683217 1040428219 /nfs/dbraw/zinc/42/82/19/1040428219.db2.gz LNOSVOHGCRIIDT-SFHVURJKSA-N 1 1 336.395 4.117 20 5 EIBDMO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482683217 1040428225 /nfs/dbraw/zinc/42/82/25/1040428225.db2.gz LNOSVOHGCRIIDT-SFHVURJKSA-N 1 1 336.395 4.117 20 5 EIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC000462454436 1040619270 /nfs/dbraw/zinc/61/92/70/1040619270.db2.gz HALGVZJFZXRPNR-CABCVRRESA-N 1 1 345.468 4.096 20 5 EIBDMO C[C@H](c1ccsc1)[NH+]1CCN([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000462454438 1040619410 /nfs/dbraw/zinc/61/94/10/1040619410.db2.gz HALGVZJFZXRPNR-HUUCEWRRSA-N 1 1 345.468 4.096 20 5 EIBDMO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1ccc(F)cc1F ZINC000160801995 1040771347 /nfs/dbraw/zinc/77/13/47/1040771347.db2.gz KDECIKZERCZLIS-MRXNPFEDSA-N 1 1 336.338 4.123 20 5 EIBDMO C[C@@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H]1C ZINC000539825906 1040821577 /nfs/dbraw/zinc/82/15/77/1040821577.db2.gz XRMPGKKHASICCW-OLZOCXBDSA-N 1 1 331.441 4.196 20 5 EIBDMO C[C@H]1C[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC[C@@H]1C ZINC000539825908 1040821915 /nfs/dbraw/zinc/82/19/15/1040821915.db2.gz XRMPGKKHASICCW-STQMWFEESA-N 1 1 331.441 4.196 20 5 EIBDMO C[C@@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)c1cccc([N+](=O)[O-])c1 ZINC000537941331 1040906418 /nfs/dbraw/zinc/90/64/18/1040906418.db2.gz PFOLBRIEHXZDSB-CYBMUJFWSA-N 1 1 329.400 4.018 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cccc(OC(C)(C)C)n1 ZINC000537940992 1040907987 /nfs/dbraw/zinc/90/79/87/1040907987.db2.gz DSBBHAZWDUMURX-AWEZNQCLSA-N 1 1 343.427 4.326 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccccc1OC(C)C ZINC000538125405 1041082602 /nfs/dbraw/zinc/08/26/02/1041082602.db2.gz VWMAGTJYMKBBDN-AWEZNQCLSA-N 1 1 344.411 4.241 20 5 EIBDMO Cc1ccc(C[N@H+](C)[C@H]2CCCC[C@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000463038890 1041263648 /nfs/dbraw/zinc/26/36/48/1041263648.db2.gz ZSEIFAAIQOYXDP-KGLIPLIRSA-N 1 1 330.350 4.456 20 5 EIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@@H]1CCc1ccccc1 ZINC000505863797 1041418539 /nfs/dbraw/zinc/41/85/39/1041418539.db2.gz HDFAHVZULWMCLA-MRXNPFEDSA-N 1 1 328.387 4.331 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H]1c1cccn1C ZINC000470169898 1041427224 /nfs/dbraw/zinc/42/72/24/1041427224.db2.gz LNWNUTGPUXPMRN-LBKOFNPBSA-N 1 1 325.412 4.174 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](COc2ccccc2)C1 ZINC000505875179 1041458191 /nfs/dbraw/zinc/45/81/91/1041458191.db2.gz STBZYPJRBOGAES-IAGOWNOFSA-N 1 1 340.423 4.365 20 5 EIBDMO CCC[C@@H]1CCCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000541696413 1042069125 /nfs/dbraw/zinc/06/91/25/1042069125.db2.gz DWIJNQKHSMHHEY-MRXNPFEDSA-N 1 1 329.400 4.404 20 5 EIBDMO COc1cccc(F)c1[C@H](C)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000122461370 1042085359 /nfs/dbraw/zinc/08/53/59/1042085359.db2.gz VYLXXKLWSJYBGM-STQMWFEESA-N 1 1 332.375 4.463 20 5 EIBDMO COc1cc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)ccc1SC ZINC000541773005 1042111052 /nfs/dbraw/zinc/11/10/52/1042111052.db2.gz MYPGYXVVIHOEMD-UHFFFAOYSA-N 1 1 346.452 4.266 20 5 EIBDMO CC(C)c1ccc(C[N@H+]2CCC3(CCOCC3)[C@@H]2C)cc1[N+](=O)[O-] ZINC000517628617 1042114756 /nfs/dbraw/zinc/11/47/56/1042114756.db2.gz ITMKWAVWCNETCM-HNNXBMFYSA-N 1 1 332.444 4.109 20 5 EIBDMO C[C@H]1C[C@@H](c2ccccc2F)[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000464729244 1042143885 /nfs/dbraw/zinc/14/38/85/1042143885.db2.gz DDMQSTAPTZYJBE-KSSFIOAISA-N 1 1 344.386 4.196 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000464856893 1042191527 /nfs/dbraw/zinc/19/15/27/1042191527.db2.gz SKYMFWAUXGJLSI-CJNGLKHVSA-N 1 1 330.384 4.170 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000464856893 1042191528 /nfs/dbraw/zinc/19/15/28/1042191528.db2.gz SKYMFWAUXGJLSI-CJNGLKHVSA-N 1 1 330.384 4.170 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](C)C[C@H]1c1ccco1 ZINC000464856892 1042191798 /nfs/dbraw/zinc/19/17/98/1042191798.db2.gz SKYMFWAUXGJLSI-BBRMVZONSA-N 1 1 330.384 4.170 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C)C[C@H]1c1ccco1 ZINC000464856892 1042191802 /nfs/dbraw/zinc/19/18/02/1042191802.db2.gz SKYMFWAUXGJLSI-BBRMVZONSA-N 1 1 330.384 4.170 20 5 EIBDMO C[C@@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@@H](c2ccco2)C1 ZINC000464859003 1042203125 /nfs/dbraw/zinc/20/31/25/1042203125.db2.gz PPFNLQCISKCAQE-RHSMWYFYSA-N 1 1 330.384 4.040 20 5 EIBDMO COc1ccc([C@H](C)[N@@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])cc1 ZINC000506325965 1042315624 /nfs/dbraw/zinc/31/56/24/1042315624.db2.gz OIYWPMHFIYRGIH-LYASGUKUSA-N 1 1 326.396 4.310 20 5 EIBDMO CCOc1cc(C[N@@H+](CC)[C@@H](C)c2cccc(O)c2)ccc1[N+](=O)[O-] ZINC000492789822 1042750286 /nfs/dbraw/zinc/75/02/86/1042750286.db2.gz NEGHGQOWWGCTFT-AWEZNQCLSA-N 1 1 344.411 4.282 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](Nc3ccccc3)C2)cc1Cl ZINC000761515951 1042874507 /nfs/dbraw/zinc/87/45/07/1042874507.db2.gz XTZTVRMTYWAOIM-INIZCTEOSA-N 1 1 345.830 4.325 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](Nc3ccccc3)C2)cc1Cl ZINC000761515951 1042874510 /nfs/dbraw/zinc/87/45/10/1042874510.db2.gz XTZTVRMTYWAOIM-INIZCTEOSA-N 1 1 345.830 4.325 20 5 EIBDMO CC[C@@](C)([NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1)c1nccs1 ZINC000152623800 1042921807 /nfs/dbraw/zinc/92/18/07/1042921807.db2.gz OUHINLZAJUCBTC-CQSZACIVSA-N 1 1 325.821 4.120 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[NH+]1CCC(c2ncccc2Cl)CC1 ZINC000429220441 1043371188 /nfs/dbraw/zinc/37/11/88/1043371188.db2.gz NZBYASUHYCTSEW-UHFFFAOYSA-N 1 1 331.803 4.023 20 5 EIBDMO C[C@@H]([NH2+][C@@H](CN1CCCC1)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000173304445 1043889047 /nfs/dbraw/zinc/88/90/47/1043889047.db2.gz QJSUSTJRRAKPFE-UZLBHIALSA-N 1 1 339.439 4.083 20 5 EIBDMO C[C@H]([NH2+][C@H](c1ccccc1)c1ccncc1)c1cccc([N+](=O)[O-])c1 ZINC000173980900 1044203238 /nfs/dbraw/zinc/20/32/38/1044203238.db2.gz UUXOIVXUMCFYKE-MGPUTAFESA-N 1 1 333.391 4.430 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccc3cccnc32)C2CC2)cc1 ZINC000130562065 1044645554 /nfs/dbraw/zinc/64/55/54/1044645554.db2.gz YXXZOTYGJLPVMD-UHFFFAOYSA-N 1 1 333.391 4.308 20 5 EIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC000734839098 1044696255 /nfs/dbraw/zinc/69/62/55/1044696255.db2.gz WJIKGEXXCFIIKI-LBPRGKRZSA-N 1 1 334.778 4.377 20 5 EIBDMO C[C@H]([NH2+]Cc1nc2ccc(F)cc2s1)c1cccc([N+](=O)[O-])c1 ZINC000428858014 1044736942 /nfs/dbraw/zinc/73/69/42/1044736942.db2.gz WQYJGUNPMZKDCY-JTQLQIEISA-N 1 1 331.372 4.194 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1c[nH]nc1-c1ccccc1)C1CC1 ZINC000154305234 1044763849 /nfs/dbraw/zinc/76/38/49/1044763849.db2.gz NMPHXGNRZGKKMF-UHFFFAOYSA-N 1 1 348.406 4.150 20 5 EIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1c[nH]nc1-c1ccccc1)C1CC1 ZINC000154305234 1044763866 /nfs/dbraw/zinc/76/38/66/1044763866.db2.gz NMPHXGNRZGKKMF-UHFFFAOYSA-N 1 1 348.406 4.150 20 5 EIBDMO CC(C)([NH2+]Cc1nc2ccc(F)cc2s1)c1ccc([N+](=O)[O-])cc1 ZINC000428876459 1044805056 /nfs/dbraw/zinc/80/50/56/1044805056.db2.gz MDLGCAHRBLDZOF-UHFFFAOYSA-N 1 1 345.399 4.369 20 5 EIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@H](c3ccccn3)C3CC3)o2)c1 ZINC000922586990 1044831785 /nfs/dbraw/zinc/83/17/85/1044831785.db2.gz UZSRGSDJZZNSJL-FQEVSTJZSA-N 1 1 349.390 4.491 20 5 EIBDMO CCOC[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000093838731 1044855713 /nfs/dbraw/zinc/85/57/13/1044855713.db2.gz IOQULNBTWCDFTJ-AWEZNQCLSA-N 1 1 346.452 4.182 20 5 EIBDMO COCC[C@@H]1CCCC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000470208343 1045064681 /nfs/dbraw/zinc/06/46/81/1045064681.db2.gz RLOCHBVYXWLCMQ-WBILKINKSA-N 1 1 332.444 4.137 20 5 EIBDMO C[C@@H]1C[C@@H](Nc2sccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000302032187 1045157665 /nfs/dbraw/zinc/15/76/65/1045157665.db2.gz SMYYEOQBLLEENJ-HIFRSBDPSA-N 1 1 331.441 4.121 20 5 EIBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(c3cccnc3)CC2)ccc1Cl ZINC000768755757 1045837276 /nfs/dbraw/zinc/83/72/76/1045837276.db2.gz OKGYSHXVAQVOOZ-UHFFFAOYSA-N 1 1 331.803 4.023 20 5 EIBDMO COc1ccc(C[N@@H+](C)[C@@H](c2ccccc2)C(C)C)cc1[N+](=O)[O-] ZINC000497396172 1046798596 /nfs/dbraw/zinc/79/85/96/1046798596.db2.gz JZIGFVSGHPELGD-LJQANCHMSA-N 1 1 328.412 4.433 20 5 EIBDMO Cc1cccc(C[N@H+](C)Cn2c3cc([N+](=O)[O-])ccc3oc2=S)c1 ZINC000917486566 1046918310 /nfs/dbraw/zinc/91/83/10/1046918310.db2.gz JPRWYYQOVORPRC-UHFFFAOYSA-N 1 1 343.408 4.270 20 5 EIBDMO Cc1cccc(C[N@@H+](C)Cn2c3cc([N+](=O)[O-])ccc3oc2=S)c1 ZINC000917486566 1046918328 /nfs/dbraw/zinc/91/83/28/1046918328.db2.gz JPRWYYQOVORPRC-UHFFFAOYSA-N 1 1 343.408 4.270 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H]1c1cc(C)on1 ZINC000787405949 1047006030 /nfs/dbraw/zinc/00/60/30/1047006030.db2.gz IVSAYAPLSPULEE-FHLIRTJZSA-N 1 1 327.384 4.132 20 5 EIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H]1c1cc(C)on1 ZINC000787405949 1047006045 /nfs/dbraw/zinc/00/60/45/1047006045.db2.gz IVSAYAPLSPULEE-FHLIRTJZSA-N 1 1 327.384 4.132 20 5 EIBDMO Cc1cccc([C@@H]2CCC[N@H+]2Cn2ncc3cc([N+](=O)[O-])ccc32)c1 ZINC000917617639 1047029952 /nfs/dbraw/zinc/02/99/52/1047029952.db2.gz NPWHYOALPLPFBX-SFHVURJKSA-N 1 1 336.395 4.048 20 5 EIBDMO C[C@H]1C[C@H](c2ccccc2)[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC001170084549 1047184237 /nfs/dbraw/zinc/18/42/37/1047184237.db2.gz BWZIUQKAQXUIBP-HNAYVOBHSA-N 1 1 326.396 4.057 20 5 EIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](CSc3ccccc3)C2)cc1F ZINC000788480031 1047197332 /nfs/dbraw/zinc/19/73/32/1047197332.db2.gz FYFRSSPQMQVIBA-OAHLLOKOSA-N 1 1 346.427 4.348 20 5 EIBDMO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788502221 1047207935 /nfs/dbraw/zinc/20/79/35/1047207935.db2.gz ICFNGNNWWXCHFS-VLIAUNLRSA-N 1 1 348.406 4.012 20 5 EIBDMO C[C@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788507479 1047209867 /nfs/dbraw/zinc/20/98/67/1047209867.db2.gz QQPUXGMWYSLCDJ-ORAYPTAESA-N 1 1 337.379 4.210 20 5 EIBDMO Cc1ccc([C@H](C)[NH2+][C@@H]2COCc3cccc(Cl)c32)cc1[N+](=O)[O-] ZINC000788667295 1047268728 /nfs/dbraw/zinc/26/87/28/1047268728.db2.gz UPRQAQXXWCTFRZ-BLLLJJGKSA-N 1 1 346.814 4.479 20 5 EIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3ccc(Cl)nc3)C2)cc1 ZINC000824820804 1047959996 /nfs/dbraw/zinc/95/99/96/1047959996.db2.gz NNLUYPFPZGTBFV-HNNXBMFYSA-N 1 1 331.803 4.023 20 5 EIBDMO CC(C)OCCC[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000556895075 1048120627 /nfs/dbraw/zinc/12/06/27/1048120627.db2.gz IYFWQCZKVZBVRH-UHFFFAOYSA-N 1 1 332.400 4.102 20 5 EIBDMO CC[C@H](c1ccccc1OC)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC001170770062 1048221677 /nfs/dbraw/zinc/22/16/77/1048221677.db2.gz XTYCDPXTVYKCMS-GOSISDBHSA-N 1 1 328.412 4.229 20 5 EIBDMO O=[N+]([O-])c1cc(CNc2cccc(C3CC3)[nH+]2)ccc1Br ZINC000815144386 1048366770 /nfs/dbraw/zinc/36/67/70/1048366770.db2.gz YTKDKQVYCWTXPR-UHFFFAOYSA-N 1 1 348.200 4.242 20 5 EIBDMO C[C@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1nc2ccccc2s1 ZINC000815580139 1048521003 /nfs/dbraw/zinc/52/10/03/1048521003.db2.gz CQMHXYITDHWJMP-QWRGUYRKSA-N 1 1 342.424 4.199 20 5 EIBDMO C[C@@H]([NH2+]Cc1c(Cl)cccc1Cl)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815572165 1048535061 /nfs/dbraw/zinc/53/50/61/1048535061.db2.gz WFAHENWFMDNHMW-SECBINFHSA-N 1 1 340.210 4.335 20 5 EIBDMO COCCCCc1ccc[nH+]c1NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000812345954 1049448849 /nfs/dbraw/zinc/44/88/49/1049448849.db2.gz YGJHFRLTDCJRLL-UHFFFAOYSA-N 1 1 349.818 4.224 20 5 EIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812849772 1049611715 /nfs/dbraw/zinc/61/17/15/1049611715.db2.gz JEEYNBKZLMOOTF-FZKQIMNGSA-N 1 1 348.830 4.192 20 5 EIBDMO CCOc1cc(C[N@@H+]2C[C@H](C(F)(F)F)CC[C@H]2C)ccc1[N+](=O)[O-] ZINC000617219571 1049970602 /nfs/dbraw/zinc/97/06/02/1049970602.db2.gz ZQRUYXONQXJGDF-DGCLKSJQSA-N 1 1 346.349 4.156 20 5 EIBDMO CCOc1cc(C[N@H+]2C[C@H](C(F)(F)F)CC[C@H]2C)ccc1[N+](=O)[O-] ZINC000617219571 1049970605 /nfs/dbraw/zinc/97/06/05/1049970605.db2.gz ZQRUYXONQXJGDF-DGCLKSJQSA-N 1 1 346.349 4.156 20 5 EIBDMO CC(C)C[N@H+]1CC[C@@H](CNc2c(Cl)cc([N+](=O)[O-])cc2Cl)C1 ZINC001185793846 1050160796 /nfs/dbraw/zinc/16/07/96/1050160796.db2.gz VJSNKEBKVYYCBA-NSHDSACASA-N 1 1 346.258 4.291 20 5 EIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC=C(c2ccc(Cl)nc2)CC1 ZINC000773667090 1050206001 /nfs/dbraw/zinc/20/60/01/1050206001.db2.gz LQSUWPFZWOFVNH-CYBMUJFWSA-N 1 1 343.814 4.494 20 5 EIBDMO CC1(C)C[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCC1(F)F ZINC001172904559 1050206855 /nfs/dbraw/zinc/20/68/55/1050206855.db2.gz OLXRQKRXMRFPTH-OAHLLOKOSA-N 1 1 338.398 4.209 20 5 EIBDMO C[N@@H+](CCc1ccccc1F)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172913715 1050231695 /nfs/dbraw/zinc/23/16/95/1050231695.db2.gz UKEDVAYUXDVAHY-SFHVURJKSA-N 1 1 342.414 4.156 20 5 EIBDMO C[N@@H+](Cc1cccc(F)c1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172910402 1050245631 /nfs/dbraw/zinc/24/56/31/1050245631.db2.gz ZBVHCXNHJQGQLF-GOSISDBHSA-N 1 1 328.387 4.113 20 5 EIBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCC[C@H]1c1ccccn1)CC2 ZINC001172912628 1050245973 /nfs/dbraw/zinc/24/59/73/1050245973.db2.gz BZOGHFRKZPCBKF-PXNSSMCTSA-N 1 1 337.423 4.074 20 5 EIBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)Cc2ccccc2C)c1F ZINC001173189915 1050337454 /nfs/dbraw/zinc/33/74/54/1050337454.db2.gz OSXLZZYMLQXTKZ-AWEZNQCLSA-N 1 1 346.402 4.114 20 5 EIBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC23CCCCC3)c1F ZINC001173182833 1050337891 /nfs/dbraw/zinc/33/78/91/1050337891.db2.gz UMJOWDJDEIDLSM-ZDUSSCGKSA-N 1 1 336.407 4.082 20 5 EIBDMO CCC[N@@H+](CC(C)C)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173194289 1050339701 /nfs/dbraw/zinc/33/97/01/1050339701.db2.gz ZBZDBLYARUTQNH-ZDUSSCGKSA-N 1 1 326.412 4.042 20 5 EIBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)CC2CCCCC2)c1F ZINC001173195175 1050341020 /nfs/dbraw/zinc/34/10/20/1050341020.db2.gz CURLIWVZAPZQRR-ZDUSSCGKSA-N 1 1 338.423 4.186 20 5 EIBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCSC[C@@H]1c1ccccc1 ZINC001173228398 1050357204 /nfs/dbraw/zinc/35/72/04/1050357204.db2.gz VWJRYGBONXNMDD-DNVCBOLYSA-N 1 1 342.464 4.316 20 5 EIBDMO CC[N@@H+](Cc1cccc(OC)c1)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173234604 1050361687 /nfs/dbraw/zinc/36/16/87/1050361687.db2.gz SKLGOMUZDQHRQT-OAHLLOKOSA-N 1 1 328.412 4.057 20 5 EIBDMO COc1ccccc1[C@@H](C)[N@@H+](C)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173234204 1050363365 /nfs/dbraw/zinc/36/33/65/1050363365.db2.gz PVJXTSDXYMNHDI-HUUCEWRRSA-N 1 1 328.412 4.227 20 5 EIBDMO COc1cccc([C@@H]2CCC[N@H+]2[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173234803 1050363595 /nfs/dbraw/zinc/36/35/95/1050363595.db2.gz UEQFQWHXKYFOEF-YWZLYKJASA-N 1 1 340.423 4.372 20 5 EIBDMO CCOc1ccc2c(c1)C[N@H+](Cc1c(C)ccc([N+](=O)[O-])c1C)CC2 ZINC001179989747 1050842316 /nfs/dbraw/zinc/84/23/16/1050842316.db2.gz VJDTYQZIFCILTC-UHFFFAOYSA-N 1 1 340.423 4.169 20 5 EIBDMO CC(C)[N@H+](Cc1nc2ccc(F)cc2o1)Cc1ccc([N+](=O)[O-])cc1 ZINC000163124133 1050932609 /nfs/dbraw/zinc/93/26/09/1050932609.db2.gz HNZFTXYNEFJTQL-UHFFFAOYSA-N 1 1 343.358 4.286 20 5 EIBDMO CC(C)[N@@H+](Cc1nc2ccc(F)cc2o1)Cc1ccc([N+](=O)[O-])cc1 ZINC000163124133 1050932619 /nfs/dbraw/zinc/93/26/19/1050932619.db2.gz HNZFTXYNEFJTQL-UHFFFAOYSA-N 1 1 343.358 4.286 20 5 EIBDMO COc1c(O)ccc(C[N@@H+]2CCCC[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC001180585459 1051043561 /nfs/dbraw/zinc/04/35/61/1051043561.db2.gz MORWEECBAJSKCF-INIZCTEOSA-N 1 1 342.395 4.036 20 5 EIBDMO COc1c(O)ccc(C[N@H+]2CCCC[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC001180585459 1051043578 /nfs/dbraw/zinc/04/35/78/1051043578.db2.gz MORWEECBAJSKCF-INIZCTEOSA-N 1 1 342.395 4.036 20 5 EIBDMO C[C@H](c1ccccc1Cl)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC001190418254 1051178504 /nfs/dbraw/zinc/17/85/04/1051178504.db2.gz YBDHJRUNZLGLGC-CYBMUJFWSA-N 1 1 334.803 4.320 20 5 EIBDMO CC(C)[N@H+](CCc1ccccc1)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC001190582138 1051224780 /nfs/dbraw/zinc/22/47/80/1051224780.db2.gz QFXBMAHLBHQVGY-UHFFFAOYSA-N 1 1 334.366 4.326 20 5 EIBDMO CC(C)[N@@H+](CCc1ccccc1)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC001190582138 1051224790 /nfs/dbraw/zinc/22/47/90/1051224790.db2.gz QFXBMAHLBHQVGY-UHFFFAOYSA-N 1 1 334.366 4.326 20 5 EIBDMO C[C@@H](Cc1ccc(Cl)cc1)[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC001191003914 1051323444 /nfs/dbraw/zinc/32/34/44/1051323444.db2.gz LYGOTAJORWVVNH-LBPRGKRZSA-N 1 1 336.794 4.450 20 5 EIBDMO Cc1ccccc1[C@@H](C)[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC001175035360 1051327281 /nfs/dbraw/zinc/32/72/81/1051327281.db2.gz GHZGQGLKJLUFNE-MRXNPFEDSA-N 1 1 328.412 4.365 20 5 EIBDMO C[C@H]1C[C@H](C(C)(C)C)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC001182182848 1051412355 /nfs/dbraw/zinc/41/23/55/1051412355.db2.gz FTUVYVUGUJIMKH-QWHCGFSZSA-N 1 1 331.416 4.383 20 5 EIBDMO COc1cccc(CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC001192392459 1051720620 /nfs/dbraw/zinc/72/06/20/1051720620.db2.gz ZZWPXGGHIKJRDR-UHFFFAOYSA-N 1 1 340.423 4.201 20 5 EIBDMO C[C@@H](c1ccco1)[N@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000131059284 1051840333 /nfs/dbraw/zinc/84/03/33/1051840333.db2.gz PURLIGGECJPZCU-JTQLQIEISA-N 1 1 339.189 4.143 20 5 EIBDMO C[C@@H](c1ccco1)[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000131059284 1051840336 /nfs/dbraw/zinc/84/03/36/1051840336.db2.gz PURLIGGECJPZCU-JTQLQIEISA-N 1 1 339.189 4.143 20 5 EIBDMO CCC[N@@H+](CCc1cccs1)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC001193141758 1051879071 /nfs/dbraw/zinc/87/90/71/1051879071.db2.gz NOAGCTJQBVBNNR-UHFFFAOYSA-N 1 1 340.395 4.389 20 5 EIBDMO Cc1ccc([C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)c(C)c1 ZINC001194074593 1052070082 /nfs/dbraw/zinc/07/00/82/1052070082.db2.gz YBPAJLKYLXTIKO-INIZCTEOSA-N 1 1 328.387 4.340 20 5 EIBDMO C[C@H]1CCC[N@@H+](CCCCNc2ncc([N+](=O)[O-])c3ccccc32)C1 ZINC001184873254 1052122440 /nfs/dbraw/zinc/12/24/40/1052122440.db2.gz ADTUECQYGFHFRV-HNNXBMFYSA-N 1 1 342.443 4.067 20 5 EIBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@H]2/C=C\c2ccccc2)cc1 ZINC001176641221 1052150267 /nfs/dbraw/zinc/15/02/67/1052150267.db2.gz QQRFPNBFCQOHIR-GIFJBRJJSA-N 1 1 338.407 4.151 20 5 EIBDMO CCCC[N@H+]1CCCC[C@H]1CNc1ncc([N+](=O)[O-])c2ccccc21 ZINC001185097680 1052166274 /nfs/dbraw/zinc/16/62/74/1052166274.db2.gz BBVIPTTYLKXHEC-HNNXBMFYSA-N 1 1 342.443 4.210 20 5 EIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+](C3CC3)[C@@H]3CCc4ccccc43)nc2c1 ZINC000083169189 1052844449 /nfs/dbraw/zinc/84/44/49/1052844449.db2.gz PEXZDHWIXKRGQL-GOSISDBHSA-N 1 1 349.390 4.388 20 5 EIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@](C)(C(=O)OC(C)(C)C)C1 ZINC001194905789 1053156202 /nfs/dbraw/zinc/15/62/02/1053156202.db2.gz LMFZVMJKNUAVPP-KUHUBIRLSA-N 1 1 348.443 4.018 20 5 EIBDMO Cc1cccc([C@H]2CCC[N@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1C ZINC000776582774 1053561082 /nfs/dbraw/zinc/56/10/82/1053561082.db2.gz BUIPVLGNLWJTQM-WOJBJXKFSA-N 1 1 340.423 4.082 20 5 EIBDMO Cc1ccc([C@H]2CCCCC[N@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000776584729 1053561743 /nfs/dbraw/zinc/56/17/43/1053561743.db2.gz PKNBHDZLXTVBIS-QZTJIDSGSA-N 1 1 344.411 4.147 20 5 EIBDMO CC[C@@H](c1ccccc1)[N@@H+](CC)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580272 1053564428 /nfs/dbraw/zinc/56/44/28/1053564428.db2.gz RWGKIXYCYSAHIX-OALUTQOASA-N 1 1 328.412 4.101 20 5 EIBDMO O=[N+]([O-])c1cccc(Br)c1CNc1cccc(C2CC2)[nH+]1 ZINC001202520187 1053629685 /nfs/dbraw/zinc/62/96/85/1053629685.db2.gz NBLXVUNOPSAJQI-UHFFFAOYSA-N 1 1 348.200 4.242 20 5 EIBDMO CC(C)C[N@H+](Cc1cccc(Cl)c1)Cc1cccnc1[N+](=O)[O-] ZINC001196410744 1053665639 /nfs/dbraw/zinc/66/56/39/1053665639.db2.gz UDHQQIQICFGHGD-UHFFFAOYSA-N 1 1 333.819 4.301 20 5 EIBDMO CC(C)C[N@@H+](Cc1cccc(Cl)c1)Cc1cccnc1[N+](=O)[O-] ZINC001196410744 1053665650 /nfs/dbraw/zinc/66/56/50/1053665650.db2.gz UDHQQIQICFGHGD-UHFFFAOYSA-N 1 1 333.819 4.301 20 5 EIBDMO CC[C@H](CO)[N@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC001197116566 1053839955 /nfs/dbraw/zinc/83/99/55/1053839955.db2.gz SAWCAWBLLQBJDI-MRXNPFEDSA-N 1 1 348.830 4.021 20 5 EIBDMO CC[C@H](CO)[N@@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC001197116566 1053839958 /nfs/dbraw/zinc/83/99/58/1053839958.db2.gz SAWCAWBLLQBJDI-MRXNPFEDSA-N 1 1 348.830 4.021 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCC3(CCCCC3)C2)c2c(c1)COCO2 ZINC000552256524 1053844412 /nfs/dbraw/zinc/84/44/12/1053844412.db2.gz OXIMLVJRKYEFFL-UHFFFAOYSA-N 1 1 346.427 4.008 20 5 EIBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCCCC[C@@H]2C[C@H](O)c2ccco2)c1 ZINC000121794706 1053847921 /nfs/dbraw/zinc/84/79/21/1053847921.db2.gz FWOXDNGBUUWYTL-AEFFLSMTSA-N 1 1 344.411 4.056 20 5 EIBDMO Cc1cc(NC[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000301402483 1053871372 /nfs/dbraw/zinc/87/13/72/1053871372.db2.gz DBHHFAZWGOOULM-KBXCAEBGSA-N 1 1 345.468 4.460 20 5 EIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)cc1[N+](=O)[O-] ZINC001168553460 1053888640 /nfs/dbraw/zinc/88/86/40/1053888640.db2.gz RGXJEXGYXSSGSC-LLVKDONJSA-N 1 1 349.774 4.316 20 5 EIBDMO Cc1cc(Nc2cccc([C@@H](C)[NH+]3CCOCC3)c2)ccc1[N+](=O)[O-] ZINC000552387908 1053893651 /nfs/dbraw/zinc/89/36/51/1053893651.db2.gz FKZCBULNXAFRPQ-OAHLLOKOSA-N 1 1 341.411 4.040 20 5 EIBDMO C[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])cc2F)[C@@H]1c1cccs1 ZINC000301427588 1053928104 /nfs/dbraw/zinc/92/81/04/1053928104.db2.gz PLKQTCYXFUCXKV-SJKOYZFVSA-N 1 1 349.431 4.290 20 5 EIBDMO CC(C)(C)OC[C@H]1CCC[N@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001197639729 1053969320 /nfs/dbraw/zinc/96/93/20/1053969320.db2.gz TUEVHPIQZAKLRF-CYBMUJFWSA-N 1 1 326.824 4.028 20 5 EIBDMO COc1ccc([C@@H](C)[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1F ZINC000872018902 1054334844 /nfs/dbraw/zinc/33/48/44/1054334844.db2.gz QWIMFSLVXDWLBA-GHMZBOCLSA-N 1 1 336.338 4.293 20 5 EIBDMO C[C@H]([NH2+][C@@H](c1ccccc1)[C@@H]1CCCO1)c1c(F)cccc1[N+](=O)[O-] ZINC000872026929 1054343278 /nfs/dbraw/zinc/34/32/78/1054343278.db2.gz AAAOHGICLUMYIN-IXDGSTSKSA-N 1 1 344.386 4.305 20 5 EIBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc(C)c(C)n1 ZINC000872078198 1054381354 /nfs/dbraw/zinc/38/13/54/1054381354.db2.gz FXWGEYCSVJWOEX-CYBMUJFWSA-N 1 1 331.441 4.179 20 5 EIBDMO COc1ccc(C[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)c(F)c1 ZINC001201408801 1054784619 /nfs/dbraw/zinc/78/46/19/1054784619.db2.gz XNVPHKOBQYZQAG-UHFFFAOYSA-N 1 1 332.375 4.156 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](c3nccs3)C2)ccc1Cl ZINC000153653592 1055890627 /nfs/dbraw/zinc/89/06/27/1055890627.db2.gz GSPVUBZDLDFFHT-GFCCVEGCSA-N 1 1 337.832 4.084 20 5 EIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](c3nccs3)C2)ccc1Cl ZINC000153653592 1055890630 /nfs/dbraw/zinc/89/06/30/1055890630.db2.gz GSPVUBZDLDFFHT-GFCCVEGCSA-N 1 1 337.832 4.084 20 5 EIBDMO CC[C@H](O)C[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542928026 1056777117 /nfs/dbraw/zinc/77/71/17/1056777117.db2.gz OODVPLXQRIMEJI-KRWDZBQOSA-N 1 1 348.830 4.021 20 5 EIBDMO CC[C@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542928026 1056777124 /nfs/dbraw/zinc/77/71/24/1056777124.db2.gz OODVPLXQRIMEJI-KRWDZBQOSA-N 1 1 348.830 4.021 20 5 EIBDMO CCc1ccc(N2CC[NH+]([C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000743868327 1059185637 /nfs/dbraw/zinc/18/56/37/1059185637.db2.gz UFUNPDGXQXVRPL-INIZCTEOSA-N 1 1 339.439 4.040 20 5 EIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC000744195626 1059323343 /nfs/dbraw/zinc/32/33/43/1059323343.db2.gz MPRAYVCPZPPJPJ-LJQANCHMSA-N 1 1 338.407 4.255 20 5 EIBDMO CCC[N@H+](Cc1ccc(OC)cc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000746142292 1060042212 /nfs/dbraw/zinc/04/22/12/1060042212.db2.gz BJUXGJRTDKRCBT-UHFFFAOYSA-N 1 1 332.375 4.155 20 5 EIBDMO CCC[N@@H+](Cc1ccc(OC)cc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000746142292 1060042228 /nfs/dbraw/zinc/04/22/28/1060042228.db2.gz BJUXGJRTDKRCBT-UHFFFAOYSA-N 1 1 332.375 4.155 20 5 EIBDMO CC[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC001169013633 1060579012 /nfs/dbraw/zinc/57/90/12/1060579012.db2.gz INNVVCKHCQZGAS-MRXNPFEDSA-N 1 1 344.386 4.079 20 5 EIBDMO CC[C@@H]1Cc2ccccc2C[N@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC001169013633 1060579035 /nfs/dbraw/zinc/57/90/35/1060579035.db2.gz INNVVCKHCQZGAS-MRXNPFEDSA-N 1 1 344.386 4.079 20 5 EIBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+](CCc2ccccc2)Cc2ccccc2)C1 ZINC001169039304 1060594602 /nfs/dbraw/zinc/59/46/02/1060594602.db2.gz PKYPRGWLLIOVFM-RTWAWAEBSA-N 1 1 338.451 4.177 20 5 EIBDMO