smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@H](SCc1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000096957141 185140305 /nfs/dbraw/zinc/14/03/05/185140305.db2.gz UXQDBKOZHBFNLL-JTQLQIEISA-N 0 0 263.318 4.182 20 5 CIBDRN O=[N+]([O-])c1cccc(Nc2cccc(C(F)(F)F)c2)c1 ZINC000169353090 188660899 /nfs/dbraw/zinc/66/08/99/188660899.db2.gz VUYHCYDTEYKDQD-UHFFFAOYSA-N 0 0 282.221 4.357 20 5 CIBDRN CCCC[C@@H](CC)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000005793059 170140794 /nfs/dbraw/zinc/14/07/94/170140794.db2.gz HUNCFEONAQQUJR-GFCCVEGCSA-N 0 0 278.352 4.058 20 5 CIBDRN O=[N+]([O-])c1cccc2ccc(/C=C/c3ccccc3F)nc21 ZINC000007621072 170294532 /nfs/dbraw/zinc/29/45/32/170294532.db2.gz PQDSEOVHIZZSST-CSKARUKUSA-N 0 0 294.285 4.453 20 5 CIBDRN CC(C)CCNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1 ZINC000007844020 170305001 /nfs/dbraw/zinc/30/50/01/170305001.db2.gz ADEOCXUBOPILBG-UHFFFAOYSA-N 0 0 291.376 4.176 20 5 CIBDRN Cc1ccccc1CNc1ccc(Cl)cc1[N+](=O)[O-] ZINC000008120178 170319784 /nfs/dbraw/zinc/31/97/84/170319784.db2.gz DZOIDZSOJARBLY-UHFFFAOYSA-N 0 0 276.723 4.169 20 5 CIBDRN CCC[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000008286458 170328891 /nfs/dbraw/zinc/32/88/91/170328891.db2.gz GRNOLUYJYAOHQR-MRXNPFEDSA-N 0 0 298.342 4.117 20 5 CIBDRN Cc1ccc(Cl)cc1NCc1cccc([N+](=O)[O-])c1 ZINC000008728719 170350194 /nfs/dbraw/zinc/35/01/94/170350194.db2.gz QDKIWKWLFAIKKS-UHFFFAOYSA-N 0 0 276.723 4.169 20 5 CIBDRN O=[N+]([O-])c1ccccc1CNc1cccc(C(F)(F)F)c1 ZINC000020042345 170976248 /nfs/dbraw/zinc/97/62/48/170976248.db2.gz VISHBIGASUYARM-UHFFFAOYSA-N 0 0 296.248 4.226 20 5 CIBDRN CSc1cccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000020086676 170987767 /nfs/dbraw/zinc/98/77/67/170987767.db2.gz IYWWMTPBKGMWRV-NSHDSACASA-N 0 0 288.372 4.490 20 5 CIBDRN Cc1ccc(N[C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000020526116 171239132 /nfs/dbraw/zinc/23/91/32/171239132.db2.gz RVJLOESRTNJCPE-GFCCVEGCSA-N 0 0 256.305 4.076 20 5 CIBDRN CC(C)c1cccc(NCc2ccccc2[N+](=O)[O-])c1 ZINC000020564878 171253520 /nfs/dbraw/zinc/25/35/20/171253520.db2.gz JSSLKJJGHXWSNU-UHFFFAOYSA-N 0 0 270.332 4.330 20 5 CIBDRN Cc1ccc(N[C@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000021016578 171289889 /nfs/dbraw/zinc/28/98/89/171289889.db2.gz WMFIGFAQYSVRBD-CYBMUJFWSA-N 0 0 270.332 4.385 20 5 CIBDRN Cc1cc(CNc2ccc([N+](=O)[O-])cc2Cl)ccc1F ZINC000022195713 171372058 /nfs/dbraw/zinc/37/20/58/171372058.db2.gz HRYDBEGNDNIKEE-UHFFFAOYSA-N 0 0 294.713 4.308 20 5 CIBDRN O=[N+]([O-])c1ccc(NCC2CCCCC2)c2ncccc12 ZINC000030550196 171618588 /nfs/dbraw/zinc/61/85/88/171618588.db2.gz XBIIWANOAJNFMP-UHFFFAOYSA-N 0 0 285.347 4.135 20 5 CIBDRN CCOc1ccc([C@H](C)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000035053533 171954375 /nfs/dbraw/zinc/95/43/75/171954375.db2.gz NSHCSJXVSKCODQ-LBPRGKRZSA-N 0 0 286.331 4.167 20 5 CIBDRN Cc1cccc(N[C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000037176734 173010785 /nfs/dbraw/zinc/01/07/85/173010785.db2.gz RSUYJRJJBXCLBK-GFCCVEGCSA-N 0 0 256.305 4.076 20 5 CIBDRN CC(C)CSc1ccc(Br)cc1[N+](=O)[O-] ZINC000042206268 174657578 /nfs/dbraw/zinc/65/75/78/174657578.db2.gz CQDCCGZPRYOQAM-UHFFFAOYSA-N 0 0 290.182 4.105 20 5 CIBDRN Cc1cc([N+](=O)[O-])ccc1NC[C@@H](c1cccnc1)C(C)C ZINC000301564054 227589177 /nfs/dbraw/zinc/58/91/77/227589177.db2.gz JVNJTTBNUBEGGJ-MRXNPFEDSA-N 0 0 299.374 4.150 20 5 CIBDRN Cc1nc(N[C@@H]2CC(C)(C)c3ccccc32)ccc1[N+](=O)[O-] ZINC000301754595 227664324 /nfs/dbraw/zinc/66/43/24/227664324.db2.gz JYYCJBRLDKGSDF-CQSZACIVSA-N 0 0 297.358 4.133 20 5 CIBDRN O=[N+]([O-])c1ccc(Nc2ccc3c(c2)COC3)c(Cl)c1 ZINC000301928871 227732250 /nfs/dbraw/zinc/73/22/50/227732250.db2.gz NAPCOSLKNGXWNH-UHFFFAOYSA-N 0 0 290.706 4.022 20 5 CIBDRN COc1cc(NCc2ccc(C3CC3)cc2)ccc1[N+](=O)[O-] ZINC000302731343 227881262 /nfs/dbraw/zinc/88/12/62/227881262.db2.gz SQRBXMCFGBHMKD-UHFFFAOYSA-N 0 0 298.342 4.093 20 5 CIBDRN C[C@H](CC(C)(C)c1ccccc1)Nc1ncccc1[N+](=O)[O-] ZINC000521357743 260085608 /nfs/dbraw/zinc/08/56/08/260085608.db2.gz JCHAQDLRXFNYMB-CYBMUJFWSA-N 0 0 299.374 4.158 20 5 CIBDRN CCc1c[nH]c(S[C@H](C)c2cc([N+](=O)[O-])ccc2C)n1 ZINC000180082420 260092221 /nfs/dbraw/zinc/09/22/21/260092221.db2.gz FGBOHFBUHBHVGO-SNVBAGLBSA-N 0 0 291.376 4.042 20 5 CIBDRN C[C@@H](N[C@@H](C)c1ccccc1F)c1ccccc1[N+](=O)[O-] ZINC000037764214 260116769 /nfs/dbraw/zinc/11/67/69/260116769.db2.gz KVMJXFUACQEDKT-NWDGAFQWSA-N 0 0 288.322 4.146 20 5 CIBDRN Cc1cccc(NCc2c(Cl)cccc2[N+](=O)[O-])c1F ZINC000312586968 260161857 /nfs/dbraw/zinc/16/18/57/260161857.db2.gz NIIGOIHOJGLEKH-UHFFFAOYSA-N 0 0 294.713 4.308 20 5 CIBDRN CC[C@H](Nc1ccc([N+](=O)[O-])cc1Cl)c1nccs1 ZINC000078004734 260167783 /nfs/dbraw/zinc/16/77/83/260167783.db2.gz QPECSXKFDCGGIG-JTQLQIEISA-N 0 0 297.767 4.268 20 5 CIBDRN Cc1c(NCc2cccc3cccnc32)cccc1[N+](=O)[O-] ZINC000078531724 260168086 /nfs/dbraw/zinc/16/80/86/260168086.db2.gz WZKIQOLYTNWHMH-UHFFFAOYSA-N 0 0 293.326 4.064 20 5 CIBDRN CC[C@@H](Nc1cc(C)c([N+](=O)[O-])cc1F)c1nccs1 ZINC000313069185 260243984 /nfs/dbraw/zinc/24/39/84/260243984.db2.gz JRVLNCFDMDWEBH-SNVBAGLBSA-N 0 0 295.339 4.062 20 5 CIBDRN Cc1ccc(C)c(NC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000008370344 260346703 /nfs/dbraw/zinc/34/67/03/260346703.db2.gz WWRVTURLLTZIRV-UHFFFAOYSA-N 0 0 299.330 4.164 20 5 CIBDRN Cc1cscc1CNc1c2ccccc2ncc1[N+](=O)[O-] ZINC000130401822 260394693 /nfs/dbraw/zinc/39/46/93/260394693.db2.gz CZLRYKWBYKZNCX-UHFFFAOYSA-N 0 0 299.355 4.125 20 5 CIBDRN Cc1cc([N+](=O)[O-])cnc1N[C@H]1CCC[C@H]1c1ccccc1 ZINC000518391654 260396893 /nfs/dbraw/zinc/39/68/93/260396893.db2.gz JGOSTKLZSGOKFI-HOTGVXAUSA-N 0 0 297.358 4.046 20 5 CIBDRN O=[N+]([O-])c1cnc(Nc2ccc(C3CCC3)cc2)s1 ZINC000409666994 260420691 /nfs/dbraw/zinc/42/06/91/260420691.db2.gz QWHAAALXAGRWHG-UHFFFAOYSA-N 0 0 275.333 4.062 20 5 CIBDRN CC(C)(C)[C@@H](Nc1ncc([N+](=O)[O-])s1)c1ccccc1 ZINC000409722239 260428302 /nfs/dbraw/zinc/42/83/02/260428302.db2.gz SUAPOTFNZYAXGG-LBPRGKRZSA-N 0 0 291.376 4.251 20 5 CIBDRN O=[N+]([O-])c1ccc(SCc2ccc3ccccc3c2)nc1 ZINC000448045146 260745939 /nfs/dbraw/zinc/74/59/39/260745939.db2.gz ZXYOOVVDZTZNTC-UHFFFAOYSA-N 0 0 296.351 4.435 20 5 CIBDRN Cc1cc([C@H](C)Nc2ccc([N+](=O)[O-])c(C)n2)c(C)s1 ZINC000161517050 261069477 /nfs/dbraw/zinc/06/94/77/261069477.db2.gz PKWGJLUWWYKHQR-VIFPVBQESA-N 0 0 291.376 4.150 20 5 CIBDRN CCc1ccc([C@@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000155819684 261108203 /nfs/dbraw/zinc/10/82/03/261108203.db2.gz OOBZINMSLNGLRB-VXGBXAGGSA-N 0 0 288.347 4.162 20 5 CIBDRN O=C(Nc1cccc(C2CCC2)c1)c1ccccc1[N+](=O)[O-] ZINC000462382649 261206863 /nfs/dbraw/zinc/20/68/63/261206863.db2.gz CJOONHUFQGZUAL-UHFFFAOYSA-N 0 0 296.326 4.115 20 5 CIBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(C)cc1C ZINC000464713351 261215128 /nfs/dbraw/zinc/21/51/28/261215128.db2.gz PYFMEETWKAQSLX-UHFFFAOYSA-N 0 0 298.342 4.026 20 5 CIBDRN CCc1nc(CSCc2ccc([N+](=O)[O-])cc2)cs1 ZINC000105630877 261314194 /nfs/dbraw/zinc/31/41/94/261314194.db2.gz NVJAHZCCUKOHHI-UHFFFAOYSA-N 0 0 294.401 4.047 20 5 CIBDRN Cc1cc2ccccc2nc1NCc1cccc([N+](=O)[O-])c1 ZINC000301142291 261329794 /nfs/dbraw/zinc/32/97/94/261329794.db2.gz CMKDAKOCXOSKPB-UHFFFAOYSA-N 0 0 293.326 4.064 20 5 CIBDRN Cc1ccc(CNc2ccc3cc([N+](=O)[O-])ccc3n2)cc1 ZINC000301111379 261329805 /nfs/dbraw/zinc/32/98/05/261329805.db2.gz YRUBJQVEGAEMCC-UHFFFAOYSA-N 0 0 293.326 4.064 20 5 CIBDRN Cc1cccc([N+](=O)[O-])c1NCc1cccc2cccnc21 ZINC000301195816 261331007 /nfs/dbraw/zinc/33/10/07/261331007.db2.gz UHYVVUYBSRFLIJ-UHFFFAOYSA-N 0 0 293.326 4.064 20 5 CIBDRN Cc1cc(NCc2cccc3ccccc32)ncc1[N+](=O)[O-] ZINC000301438249 261333817 /nfs/dbraw/zinc/33/38/17/261333817.db2.gz SZZBJLQBPWBIQJ-UHFFFAOYSA-N 0 0 293.326 4.064 20 5 CIBDRN C[C@H](CCC1CC1)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000302222313 261349324 /nfs/dbraw/zinc/34/93/24/261349324.db2.gz OKEFSQLNVGOSTQ-LLVKDONJSA-N 0 0 285.347 4.134 20 5 CIBDRN C[C@@H](CCC1CC1)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000302222314 261349397 /nfs/dbraw/zinc/34/93/97/261349397.db2.gz OKEFSQLNVGOSTQ-NSHDSACASA-N 0 0 285.347 4.134 20 5 CIBDRN C[C@H](Nc1ccc(F)c(F)c1)c1ccccc1[N+](=O)[O-] ZINC000020526023 262244919 /nfs/dbraw/zinc/24/49/19/262244919.db2.gz MDKDWOYBYGDLFS-VIFPVBQESA-N 0 0 278.258 4.046 20 5 CIBDRN COc1ccc(C)cc1N[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000020526013 262245315 /nfs/dbraw/zinc/24/53/15/262245315.db2.gz SKEXGGXQMIZBJO-GFCCVEGCSA-N 0 0 286.331 4.085 20 5 CIBDRN O=[N+]([O-])c1cc(F)ccc1N[C@@H]1CCCc2sccc21 ZINC000061326408 262394267 /nfs/dbraw/zinc/39/42/67/262394267.db2.gz ZOPYQMMUKQFXAZ-LLVKDONJSA-N 0 0 292.335 4.285 20 5 CIBDRN O=[N+]([O-])c1ccccc1-c1nc(C2CCCC2)cs1 ZINC000474923618 264235076 /nfs/dbraw/zinc/23/50/76/264235076.db2.gz HBKWJAYINKAYRU-UHFFFAOYSA-N 0 0 274.345 4.376 20 5 CIBDRN Cc1occc1SCCCOc1ccc([N+](=O)[O-])cc1 ZINC000357090875 266245599 /nfs/dbraw/zinc/24/55/99/266245599.db2.gz YKUWBDVQFVWNSZ-UHFFFAOYSA-N 0 0 293.344 4.057 20 5 CIBDRN Cc1ccc(N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000021009336 327940279 /nfs/dbraw/zinc/94/02/79/327940279.db2.gz PJILPEFRYPWPEL-CYBMUJFWSA-N 0 0 270.332 4.385 20 5 CIBDRN CC(C)(C)Oc1cc(N[C@@H]2CC[C@@H](F)C2)ccc1[N+](=O)[O-] ZINC000571196930 328091862 /nfs/dbraw/zinc/09/18/62/328091862.db2.gz RNOULSMIXMMOPN-GHMZBOCLSA-N 0 0 296.342 4.075 20 5 CIBDRN Cc1ccc([C@H](C)Nc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000048346340 328130064 /nfs/dbraw/zinc/13/00/64/328130064.db2.gz QFZTXKYKHXFIDD-NSHDSACASA-N 0 0 274.295 4.215 20 5 CIBDRN Cc1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000048346338 328130208 /nfs/dbraw/zinc/13/02/08/328130208.db2.gz QFZTXKYKHXFIDD-LLVKDONJSA-N 0 0 274.295 4.215 20 5 CIBDRN CCc1ccc(NCc2c(F)cc([N+](=O)[O-])cc2F)cc1 ZINC000506261340 332767604 /nfs/dbraw/zinc/76/76/04/332767604.db2.gz FLMXBQCCWCXRKG-UHFFFAOYSA-N 0 0 292.285 4.048 20 5 CIBDRN Cc1ccc(-c2csc(C(C)(C)C)n2)cc1[N+](=O)[O-] ZINC000388750326 328254982 /nfs/dbraw/zinc/25/49/82/328254982.db2.gz ARQAADCNBFXYMM-UHFFFAOYSA-N 0 0 276.361 4.324 20 5 CIBDRN Cc1ccc(NCc2c(F)cc([N+](=O)[O-])cc2F)cc1C ZINC000506270219 332767829 /nfs/dbraw/zinc/76/78/29/332767829.db2.gz TXAKXORDKRMTDK-UHFFFAOYSA-N 0 0 292.285 4.102 20 5 CIBDRN Cc1cc(N[C@@H](C)Cc2ccsc2)ccc1[N+](=O)[O-] ZINC000048553072 328312251 /nfs/dbraw/zinc/31/22/51/328312251.db2.gz UJIFOHSAKQOAIJ-NSHDSACASA-N 0 0 276.361 4.008 20 5 CIBDRN CN(Cc1ccccc1[N+](=O)[O-])c1cccc2ccccc21 ZINC000065590166 328316392 /nfs/dbraw/zinc/31/63/92/328316392.db2.gz BMMPVGYSZSITFT-UHFFFAOYSA-N 0 0 292.338 4.384 20 5 CIBDRN Cc1cc(CNc2cccc([N+](=O)[O-])c2C)c(C)s1 ZINC000049686147 328378285 /nfs/dbraw/zinc/37/82/85/328378285.db2.gz VJTVVVSSGQBHIX-UHFFFAOYSA-N 0 0 276.361 4.194 20 5 CIBDRN O=[N+]([O-])c1cc(F)ccc1NCc1ccc(F)c(Cl)c1 ZINC000112013835 328381774 /nfs/dbraw/zinc/38/17/74/328381774.db2.gz OPFUTZHNGXYJLL-UHFFFAOYSA-N 0 0 298.676 4.139 20 5 CIBDRN CCC[C@@H](CC)Nc1ccc([N+](=O)[O-])c2cccnc12 ZINC000050164860 328387707 /nfs/dbraw/zinc/38/77/07/328387707.db2.gz SLVQKGJJALFMBO-LLVKDONJSA-N 0 0 273.336 4.134 20 5 CIBDRN Cc1ccc(N[C@@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000036964523 326851165 /nfs/dbraw/zinc/85/11/65/326851165.db2.gz XTONEYXQEPDIFZ-LBPRGKRZSA-N 0 0 256.305 4.076 20 5 CIBDRN CCc1ccc(NCc2ccccc2[N+](=O)[O-])cc1C ZINC000312763208 326963074 /nfs/dbraw/zinc/96/30/74/326963074.db2.gz MFSIRYTZPVJERU-UHFFFAOYSA-N 0 0 270.332 4.078 20 5 CIBDRN O=[N+]([O-])c1cc(Cl)cc(Cl)c1N1C2CCC1CC2 ZINC000557476372 327007966 /nfs/dbraw/zinc/00/79/66/327007966.db2.gz PCVPTXICWSMWPB-UHFFFAOYSA-N 0 0 287.146 4.033 20 5 CIBDRN Cc1ccc(SCCOc2ccccc2[N+](=O)[O-])cc1 ZINC000255930958 327032629 /nfs/dbraw/zinc/03/26/29/327032629.db2.gz PJSOVJOPRJNMEF-UHFFFAOYSA-N 0 0 289.356 4.074 20 5 CIBDRN O=[N+]([O-])c1ccc(CSCc2ccc(Cl)cn2)cc1 ZINC000558319151 327086915 /nfs/dbraw/zinc/08/69/15/327086915.db2.gz KPHKZLRWOWAROW-UHFFFAOYSA-N 0 0 294.763 4.077 20 5 CIBDRN CO[C@H](CSc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000559190086 327145367 /nfs/dbraw/zinc/14/53/67/327145367.db2.gz RTODGCGVPLIFAL-OAHLLOKOSA-N 0 0 289.356 4.075 20 5 CIBDRN Cc1cc(F)cc(N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000091509643 327170598 /nfs/dbraw/zinc/17/05/98/327170598.db2.gz BUIIYFMDLLVAAN-NSHDSACASA-N 0 0 274.295 4.215 20 5 CIBDRN Cc1cc(F)cc(NCc2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000091513337 327170785 /nfs/dbraw/zinc/17/07/85/327170785.db2.gz OZYFNCHOJODKFZ-UHFFFAOYSA-N 0 0 294.713 4.308 20 5 CIBDRN O=[N+]([O-])c1cccc(CSCc2ccc(F)c(F)c2)c1 ZINC000215834275 327212681 /nfs/dbraw/zinc/21/26/81/327212681.db2.gz GMORFWDGHIHUMG-UHFFFAOYSA-N 0 0 295.310 4.306 20 5 CIBDRN CC(C)(CNc1c(Cl)cccc1[N+](=O)[O-])C(F)(F)F ZINC000559392701 327243234 /nfs/dbraw/zinc/24/32/34/327243234.db2.gz DMRCRDQZTAWMJW-UHFFFAOYSA-N 0 0 296.676 4.249 20 5 CIBDRN CCc1ccc(NC(=O)c2cc(C)ccc2[N+](=O)[O-])cc1C ZINC000535807568 328638000 /nfs/dbraw/zinc/63/80/00/328638000.db2.gz SITQUNKUGORQBL-UHFFFAOYSA-N 0 0 298.342 4.026 20 5 CIBDRN C[C@@H]1C[C@H]1c1ccc(CNc2ccc([N+](=O)[O-])cc2F)o1 ZINC000042252870 328763135 /nfs/dbraw/zinc/76/31/35/328763135.db2.gz KXHGMFGTVDFMCE-BXKDBHETSA-N 0 0 290.294 4.062 20 5 CIBDRN Cc1c(F)cccc1N[C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000043319986 328786624 /nfs/dbraw/zinc/78/66/24/328786624.db2.gz ANJXASKZPKWOHA-LLVKDONJSA-N 0 0 274.295 4.215 20 5 CIBDRN Cc1ccnc(NCc2ccc3sccc3c2)c1[N+](=O)[O-] ZINC000582273688 328945008 /nfs/dbraw/zinc/94/50/08/328945008.db2.gz DIOLBAGSXYANIP-UHFFFAOYSA-N 0 0 299.355 4.125 20 5 CIBDRN O=[N+]([O-])c1ccccc1/C=C/C=C\c1nc2ccccc2o1 ZINC000508596434 332843009 /nfs/dbraw/zinc/84/30/09/332843009.db2.gz CROVVKCUFQHBCX-TXHIZOSNSA-N 0 0 292.294 4.463 20 5 CIBDRN Cc1ccc(CSCc2ccc([N+](=O)[O-])cc2)c(C)n1 ZINC000184860489 329263472 /nfs/dbraw/zinc/26/34/72/329263472.db2.gz ICTHIFPHTKWEBK-UHFFFAOYSA-N 0 0 288.372 4.040 20 5 CIBDRN Cc1cscc1N[C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000395737331 329300658 /nfs/dbraw/zinc/30/06/58/329300658.db2.gz RQBJXKORIJUVNW-SNVBAGLBSA-N 0 0 262.334 4.138 20 5 CIBDRN CSc1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000035255692 329488400 /nfs/dbraw/zinc/48/84/00/329488400.db2.gz ORXKESORRUAGMG-LLVKDONJSA-N 0 0 288.372 4.490 20 5 CIBDRN 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294.763 4.123 20 5 CIBDRN Cc1ccc(C)c(NCc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000037215978 333515813 /nfs/dbraw/zinc/51/58/13/333515813.db2.gz LOJPSWGVTYPYMT-UHFFFAOYSA-N 0 0 270.332 4.132 20 5 CIBDRN CSc1cccc(NCc2csc([N+](=O)[O-])c2)c1C ZINC000538139271 333576346 /nfs/dbraw/zinc/57/63/46/333576346.db2.gz RFGXFYCTWQAFSL-UHFFFAOYSA-N 0 0 294.401 4.299 20 5 CIBDRN CN(Cc1ccc([N+](=O)[O-])cc1)c1cccc2ccccc21 ZINC000065590198 333598194 /nfs/dbraw/zinc/59/81/94/333598194.db2.gz YLBQZZYYIBYVLC-UHFFFAOYSA-N 0 0 292.338 4.384 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)SC[C@@H]1CCCCO1 ZINC000538703694 333612589 /nfs/dbraw/zinc/61/25/89/333612589.db2.gz VEUSKZVYGBJNSE-OCCSQVGLSA-N 0 0 295.404 4.267 20 5 CIBDRN O=[N+]([O-])c1ccccc1-c1nc(Cc2ccccc2)cs1 ZINC000541269082 333769015 /nfs/dbraw/zinc/76/90/15/333769015.db2.gz VRTBDVXXUDUCJS-UHFFFAOYSA-N 0 0 296.351 4.309 20 5 CIBDRN O=[N+]([O-])c1ccc(/C=C\c2ccc3cccc(O)c3n2)s1 ZINC000543863714 333903711 /nfs/dbraw/zinc/90/37/11/333903711.db2.gz 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334469172 /nfs/dbraw/zinc/46/91/72/334469172.db2.gz XQPNIZUHUSSRKX-LLVKDONJSA-N 0 0 288.372 4.088 20 5 CIBDRN Cc1ccc(N[C@H]2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000565214355 334545492 /nfs/dbraw/zinc/54/54/92/334545492.db2.gz FTFDJSZDUYBFPB-HNNXBMFYSA-N 0 0 268.316 4.003 20 5 CIBDRN Cc1cccnc1S[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000565320665 334552831 /nfs/dbraw/zinc/55/28/31/334552831.db2.gz FNTHPLJGCMROCC-LLVKDONJSA-N 0 0 274.345 4.152 20 5 CIBDRN Cc1cccnc1S[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000567534031 334729315 /nfs/dbraw/zinc/72/93/15/334729315.db2.gz DDZASCNITGGRKY-LLVKDONJSA-N 0 0 274.345 4.152 20 5 CIBDRN Cc1cc2cc(CNc3ccc(F)cc3[N+](=O)[O-])ccc2[nH]1 ZINC000572730338 334874407 /nfs/dbraw/zinc/87/44/07/334874407.db2.gz NMCJJRAZHWNRKS-UHFFFAOYSA-N 0 0 299.305 4.136 20 5 CIBDRN Cc1cc(NCc2ccsc2)c(Cl)cc1[N+](=O)[O-] ZINC000301428182 518187715 /nfs/dbraw/zinc/18/77/15/518187715.db2.gz DVVDYURRHFPHQP-UHFFFAOYSA-N 0 0 282.752 4.230 20 5 CIBDRN CCc1cccc(C)c1NC(=O)c1cc(C)ccc1[N+](=O)[O-] ZINC000151388300 524065836 /nfs/dbraw/zinc/06/58/36/524065836.db2.gz CSMMSUZKIROEGC-UHFFFAOYSA-N 0 0 298.342 4.026 20 5 CIBDRN Cc1cccc([C@@H](C)Nc2ncc([N+](=O)[O-])cc2C)c1C ZINC000301310308 534757363 /nfs/dbraw/zinc/75/73/63/534757363.db2.gz ZGCUQJQCSJTJFQ-CYBMUJFWSA-N 0 0 285.347 4.088 20 5 CIBDRN Cc1cc([C@@H](C)Nc2c(F)cc([N+](=O)[O-])cc2F)c(C)o1 ZINC000227889142 525476030 /nfs/dbraw/zinc/47/60/30/525476030.db2.gz WBJTTXGTLRIHBA-MRVPVSSYSA-N 0 0 296.273 4.256 20 5 CIBDRN C[C@@H](Nc1ccc(Cl)cc1[N+](=O)[O-])c1ccsc1 ZINC000050341295 525705059 /nfs/dbraw/zinc/70/50/59/525705059.db2.gz PWSMPNNFTIBNQK-MRVPVSSYSA-N 0 0 282.752 4.483 20 5 CIBDRN Cc1ccc([C@H](C)Nc2c(F)cc([N+](=O)[O-])cc2F)s1 ZINC000227888814 525947456 /nfs/dbraw/zinc/94/74/56/525947456.db2.gz ISDHUWNBSPENIX-QMMMGPOBSA-N 0 0 298.314 4.416 20 5 CIBDRN Cc1ccc([C@H](C)Nc2ncc([N+](=O)[O-])cc2Cl)cc1 ZINC000227649779 525949223 /nfs/dbraw/zinc/94/92/23/525949223.db2.gz MAFRPHGEBCVEQC-JTQLQIEISA-N 0 0 291.738 4.125 20 5 CIBDRN O=[N+]([O-])c1ccc(COc2c(Cl)cccc2Cl)cc1 ZINC000058797896 527352784 /nfs/dbraw/zinc/35/27/84/527352784.db2.gz PGYUVZKNWPHXLL-UHFFFAOYSA-N 0 0 298.125 4.481 20 5 CIBDRN CC[C@@H](NCc1ccc(Cl)o1)c1cccc([N+](=O)[O-])c1 ZINC000344764772 529183807 /nfs/dbraw/zinc/18/38/07/529183807.db2.gz OKBDEOWQYSDDCP-CYBMUJFWSA-N 0 0 294.738 4.082 20 5 CIBDRN CC[C@@H](Nc1ccc([N+](=O)[O-])cn1)c1cccc(Cl)c1 ZINC000301484025 529210124 /nfs/dbraw/zinc/21/01/24/529210124.db2.gz YCAPGSNJPHHXPG-CYBMUJFWSA-N 0 0 291.738 4.206 20 5 CIBDRN O=[N+]([O-])c1cccc(Cl)c1CSCc1cccnc1 ZINC000342028507 130215381 /nfs/dbraw/zinc/21/53/81/130215381.db2.gz VXLMVPQYJRTPMH-UHFFFAOYSA-N 0 0 294.763 4.077 20 5 CIBDRN CCCC[C@@H](CC)C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000005466750 170102049 /nfs/dbraw/zinc/10/20/49/170102049.db2.gz YQQANPMIQQNUCM-GFCCVEGCSA-N 0 0 278.352 4.058 20 5 CIBDRN O=[N+]([O-])c1ccccc1CSc1ccc2ccccc2n1 ZINC000005626776 170121618 /nfs/dbraw/zinc/12/16/18/170121618.db2.gz PQLVAVPVCKVOLF-UHFFFAOYSA-N 0 0 296.351 4.435 20 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DTPYKIJVCJZLOT-GFCCVEGCSA-N 0 0 286.331 4.085 20 5 CIBDRN CC(C)c1cccc(NCc2cccc([N+](=O)[O-])c2)c1 ZINC000020552890 171248052 /nfs/dbraw/zinc/24/80/52/171248052.db2.gz UMDSFLBYWRQBKP-UHFFFAOYSA-N 0 0 270.332 4.330 20 5 CIBDRN CC(C)c1cccc(Oc2nc3ccccn3c2[N+](=O)[O-])c1 ZINC000021673698 171319095 /nfs/dbraw/zinc/31/90/95/171319095.db2.gz JXNIBKYGMQXPOW-UHFFFAOYSA-N 0 0 297.314 4.158 20 5 CIBDRN Cc1ccc(N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1F ZINC000021801264 171326049 /nfs/dbraw/zinc/32/60/49/171326049.db2.gz JVVBAVOADAKNRK-LLVKDONJSA-N 0 0 274.295 4.215 20 5 CIBDRN Cc1ccc(F)cc1N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000021801336 171326281 /nfs/dbraw/zinc/32/62/81/171326281.db2.gz ZWNBHJDJSWAFHT-NSHDSACASA-N 0 0 274.295 4.215 20 5 CIBDRN Cc1c(CNc2ccccc2Cl)cccc1[N+](=O)[O-] ZINC000035648738 172325230 /nfs/dbraw/zinc/32/52/30/172325230.db2.gz MZZUJDQNLHQBIA-UHFFFAOYSA-N 0 0 276.723 4.169 20 5 CIBDRN Cc1ccccc1N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000037177013 173010793 /nfs/dbraw/zinc/01/07/93/173010793.db2.gz QJNISWOARCMJMF-LBPRGKRZSA-N 0 0 256.305 4.076 20 5 CIBDRN Cc1ccc(CNc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000037202803 173026178 /nfs/dbraw/zinc/02/61/78/173026178.db2.gz VQGYYSRKIVJLHJ-UHFFFAOYSA-N 0 0 276.723 4.169 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)Sc1ccccn1 ZINC000179979936 260084803 /nfs/dbraw/zinc/08/48/03/260084803.db2.gz GOOCJOXNMSKYLW-LLVKDONJSA-N 0 0 274.345 4.152 20 5 CIBDRN O=[N+]([O-])c1cc(CNc2ccc(F)c(C3CC3)c2)cs1 ZINC000352629046 227124395 /nfs/dbraw/zinc/12/43/95/227124395.db2.gz OLIWKVFLBDGOBE-UHFFFAOYSA-N 0 0 292.335 4.285 20 5 CIBDRN Cc1cccc([N+](=O)[O-])c1N1CCC[C@@H]1c1cccs1 ZINC000301181144 227469401 /nfs/dbraw/zinc/46/94/01/227469401.db2.gz PTAYWIRAIWIWMB-GFCCVEGCSA-N 0 0 288.372 4.306 20 5 CIBDRN Cc1cc(SCc2cccc(Cl)c2)ncc1[N+](=O)[O-] ZINC000301443547 227540953 /nfs/dbraw/zinc/54/09/53/227540953.db2.gz PWRQJWCKJYKJDJ-UHFFFAOYSA-N 0 0 294.763 4.244 20 5 CIBDRN Cc1cc(C)cc([C@@H](C)Nc2cc(C)c([N+](=O)[O-])cn2)c1 ZINC000301449251 227541831 /nfs/dbraw/zinc/54/18/31/227541831.db2.gz SGQJMWSAFKBHTQ-CYBMUJFWSA-N 0 0 285.347 4.088 20 5 CIBDRN Cc1ccc([C@@H]2CCCCN2c2ccc([N+](=O)[O-])cn2)cc1 ZINC000301608275 227609405 /nfs/dbraw/zinc/60/94/05/227609405.db2.gz ZWTTVHBCWXHOKB-INIZCTEOSA-N 0 0 297.358 4.030 20 5 CIBDRN Cc1ccc(Cl)c(Oc2ncc(Cl)cc2[N+](=O)[O-])c1 ZINC000301729835 227655421 /nfs/dbraw/zinc/65/54/21/227655421.db2.gz CMHWBFTUOPSGIC-UHFFFAOYSA-N 0 0 299.113 4.397 20 5 CIBDRN C[C@@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000037764216 260116594 /nfs/dbraw/zinc/11/65/94/260116594.db2.gz KVMJXFUACQEDKT-VXGBXAGGSA-N 0 0 288.322 4.146 20 5 CIBDRN C[C@@H](NCc1ccsc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000312552830 260148575 /nfs/dbraw/zinc/14/85/75/260148575.db2.gz CSQZOLKXJAMMLB-SECBINFHSA-N 0 0 296.779 4.161 20 5 CIBDRN Cc1noc(C)c1[C@H](C)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000072946961 260164565 /nfs/dbraw/zinc/16/45/65/260164565.db2.gz IQXGSURCYNUCAA-ZETCQYMHSA-N 0 0 295.726 4.026 20 5 CIBDRN Cc1cc([C@H](C)Nc2cc(C)c([N+](=O)[O-])cn2)c(C)s1 ZINC000073000335 260164825 /nfs/dbraw/zinc/16/48/25/260164825.db2.gz HYYKZXUHFCWZAW-JTQLQIEISA-N 0 0 291.376 4.150 20 5 CIBDRN Cc1cc(F)cc(N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000091510274 260266610 /nfs/dbraw/zinc/26/66/10/260266610.db2.gz VBCVSGZFGAGTHT-NSHDSACASA-N 0 0 274.295 4.215 20 5 CIBDRN Cc1cc([C@H](C)Nc2ncc(Cl)cc2[N+](=O)[O-])c(C)o1 ZINC000129777447 260388907 /nfs/dbraw/zinc/38/89/07/260388907.db2.gz UVVVNFKSXUDWCE-QMMMGPOBSA-N 0 0 295.726 4.026 20 5 CIBDRN Cc1nc(N[C@@H](C)c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000161502504 261062126 /nfs/dbraw/zinc/06/21/26/261062126.db2.gz POCFFIFVKXXDIZ-VIFPVBQESA-N 0 0 291.738 4.125 20 5 CIBDRN Cc1nc(NCc2ccc(C(C)C)cc2)ccc1[N+](=O)[O-] ZINC000161534125 261087899 /nfs/dbraw/zinc/08/78/99/261087899.db2.gz NWTBKFGCWHJBPG-UHFFFAOYSA-N 0 0 285.347 4.034 20 5 CIBDRN CCc1ccc([C@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000155819567 261107876 /nfs/dbraw/zinc/10/78/76/261107876.db2.gz OOBZINMSLNGLRB-RYUDHWBXSA-N 0 0 288.347 4.162 20 5 CIBDRN Cc1nc(CS[C@@H](C)c2cccc([N+](=O)[O-])c2)cs1 ZINC000105637219 261314252 /nfs/dbraw/zinc/31/42/52/261314252.db2.gz JVWFOHADNRVVLH-VIFPVBQESA-N 0 0 294.401 4.354 20 5 CIBDRN O=[N+]([O-])c1ccc(CSc2cccs2)c(F)c1 ZINC000310259279 262129900 /nfs/dbraw/zinc/12/99/00/262129900.db2.gz HHVMTKOZZUVKRU-UHFFFAOYSA-N 0 0 269.322 4.088 20 5 CIBDRN CC(C)[C@H](c1ccccc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000497358747 262145951 /nfs/dbraw/zinc/14/59/51/262145951.db2.gz VWHLYOZGNFQIID-GOSISDBHSA-N 0 0 298.386 4.424 20 5 CIBDRN C[C@H]1CCCC[C@H]1N(C)c1ccc([N+](=O)[O-])c2cnccc21 ZINC000497551083 262175152 /nfs/dbraw/zinc/17/51/52/262175152.db2.gz ZWLWUUWIQORZHE-SWLSCSKDSA-N 0 0 299.374 4.158 20 5 CIBDRN O=C(Nc1cccc2ccsc21)c1cccc([N+](=O)[O-])c1 ZINC000501608575 262188693 /nfs/dbraw/zinc/18/86/93/262188693.db2.gz WATROIGIFDSRAE-UHFFFAOYSA-N 0 0 298.323 4.062 20 5 CIBDRN COc1ccc(C)cc1N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000020526012 262245215 /nfs/dbraw/zinc/24/52/15/262245215.db2.gz SKEXGGXQMIZBJO-LBPRGKRZSA-N 0 0 286.331 4.085 20 5 CIBDRN Cc1cc([N+](=O)[O-])ccc1N[C@H]1CSc2ccccc21 ZINC000093232581 263309771 /nfs/dbraw/zinc/30/97/71/263309771.db2.gz IXPWSWVMVFLRQJ-AWEZNQCLSA-N 0 0 286.356 4.162 20 5 CIBDRN Cc1cccc(C)c1CNc1cccc([N+](=O)[O-])c1C ZINC000096810890 265384924 /nfs/dbraw/zinc/38/49/24/265384924.db2.gz LBDYBNFUTZQLGA-UHFFFAOYSA-N 0 0 270.332 4.132 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1NCc1c(C)cccc1C ZINC000096810880 265385262 /nfs/dbraw/zinc/38/52/62/265385262.db2.gz FCRSPUXFVNNYMW-UHFFFAOYSA-N 0 0 270.332 4.132 20 5 CIBDRN Cc1ccc([N+](=O)[O-])c(NCc2ccc3sccc3c2)n1 ZINC000357607777 266335425 /nfs/dbraw/zinc/33/54/25/266335425.db2.gz QISFJZBYBDYRJS-UHFFFAOYSA-N 0 0 299.355 4.125 20 5 CIBDRN Cc1cscc1CNc1ccc([N+](=O)[O-])c2cnccc12 ZINC000094883096 327959074 /nfs/dbraw/zinc/95/90/74/327959074.db2.gz FOQOGXJNKQBXJQ-UHFFFAOYSA-N 0 0 299.355 4.125 20 5 CIBDRN CN(C(=O)CCCCC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000571293941 328100068 /nfs/dbraw/zinc/10/00/68/328100068.db2.gz OKTUDUHPHRKRCZ-UHFFFAOYSA-N 0 0 292.379 4.164 20 5 CIBDRN Cc1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000048346349 328130062 /nfs/dbraw/zinc/13/00/62/328130062.db2.gz HVNWATWGQBCDGV-CYBMUJFWSA-N 0 0 270.332 4.385 20 5 CIBDRN Cc1ccc([C@H](C)Nc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000048346350 328130182 /nfs/dbraw/zinc/13/01/82/328130182.db2.gz HVNWATWGQBCDGV-ZDUSSCGKSA-N 0 0 270.332 4.385 20 5 CIBDRN O=[N+]([O-])c1ccc(-c2csc(-c3ccccc3O)n2)cc1 ZINC000048785586 328322247 /nfs/dbraw/zinc/32/22/47/328322247.db2.gz IQXHWTNVYFQCTK-UHFFFAOYSA-N 0 0 298.323 4.091 20 5 CIBDRN O=[N+]([O-])c1ccc(-c2nc3ccc(F)cc3n2C2CC2)cc1 ZINC000534629376 328328240 /nfs/dbraw/zinc/32/82/40/328328240.db2.gz ZQSVJHAQAWVNAX-UHFFFAOYSA-N 0 0 297.289 4.086 20 5 CIBDRN CC(F)(F)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000379152769 328551762 /nfs/dbraw/zinc/55/17/62/328551762.db2.gz CUIBJIBOHLUWDJ-UHFFFAOYSA-N 0 0 298.211 4.071 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)Nc1cccc2c1CCO2 ZINC000530529534 326851574 /nfs/dbraw/zinc/85/15/74/326851574.db2.gz FBGSAPXFSLMFOS-GFCCVEGCSA-N 0 0 298.342 4.011 20 5 CIBDRN CC(=O)c1ccc(Oc2ccc([N+](=O)[O-])c(C)c2)c(C)c1 ZINC000552387932 326878285 /nfs/dbraw/zinc/87/82/85/326878285.db2.gz GCHVSPUOPQUMGD-UHFFFAOYSA-N 0 0 285.299 4.207 20 5 CIBDRN Cc1ccc(OCc2cccc3cccnc32)cc1[N+](=O)[O-] ZINC000533676195 326900440 /nfs/dbraw/zinc/90/04/40/326900440.db2.gz PMMPMOCZNXCHES-UHFFFAOYSA-N 0 0 294.310 4.030 20 5 CIBDRN Cc1cccc(OCc2sccc2Cl)c1[N+](=O)[O-] ZINC000559195317 327145605 /nfs/dbraw/zinc/14/56/05/327145605.db2.gz RBXLBPDSCLERRK-UHFFFAOYSA-N 0 0 283.736 4.197 20 5 CIBDRN O=[N+]([O-])c1ccc(Nc2cccc(-c3cccs3)c2)nc1 ZINC000507020202 332784352 /nfs/dbraw/zinc/78/43/52/332784352.db2.gz CMYZCWGZNJEQFQ-UHFFFAOYSA-N 0 0 297.339 4.462 20 5 CIBDRN CCC1(C)CCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000507033767 332784724 /nfs/dbraw/zinc/78/47/24/332784724.db2.gz GSLPFJKQDZXGDB-UHFFFAOYSA-N 0 0 299.374 4.160 20 5 CIBDRN C[C@H](Nc1cccc2ccncc21)c1ccc([N+](=O)[O-])cc1 ZINC000316596069 327176007 /nfs/dbraw/zinc/17/60/07/327176007.db2.gz TYYJILXOVVMDCH-LBPRGKRZSA-N 0 0 293.326 4.316 20 5 CIBDRN Cc1cc2cc(CNc3ccc([N+](=O)[O-])cc3F)ccc2[nH]1 ZINC000583398524 327344392 /nfs/dbraw/zinc/34/43/92/327344392.db2.gz XATIWMCQEXUAMH-UHFFFAOYSA-N 0 0 299.305 4.136 20 5 CIBDRN O=[N+]([O-])c1cccc(F)c1Oc1cccc(Cl)c1 ZINC000561098180 327366321 /nfs/dbraw/zinc/36/63/21/327366321.db2.gz TYHKOCWIQTXDFK-UHFFFAOYSA-N 0 0 267.643 4.180 20 5 CIBDRN CC(C)c1ccoc1-c1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000569751750 327544789 /nfs/dbraw/zinc/54/47/89/327544789.db2.gz QRLPLNFUWNXBLP-UHFFFAOYSA-N 0 0 299.286 4.028 20 5 CIBDRN C[C@@H]1C[C@H](C)N1C(=O)c1cc2ccccc2c2cccnc12 ZINC000525940728 329398116 /nfs/dbraw/zinc/39/81/16/329398116.db2.gz JAHKOBOINUJRIL-BETUJISGSA-N 0 0 290.366 4.011 20 5 CIBDRN CC(F)(F)c1ccc(CNc2ccccc2[N+](=O)[O-])cc1 ZINC000432135325 329805519 /nfs/dbraw/zinc/80/55/19/329805519.db2.gz HLUJKJXMVFCLFK-UHFFFAOYSA-N 0 0 292.285 4.319 20 5 CIBDRN CC[C@H](CC1CCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000510202774 332897014 /nfs/dbraw/zinc/89/70/14/332897014.db2.gz CAYURGPRCSDQFD-CYBMUJFWSA-N 0 0 290.363 4.140 20 5 CIBDRN Cc1ccccc1NC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000120196839 330386173 /nfs/dbraw/zinc/38/61/73/330386173.db2.gz AGKNNYPKKWSACK-UHFFFAOYSA-N 0 0 299.330 4.164 20 5 CIBDRN O=[N+]([O-])c1cc(CNc2c(F)cccc2Cl)cs1 ZINC000121983642 330410587 /nfs/dbraw/zinc/41/05/87/330410587.db2.gz WWGTVVAFRAIFIF-UHFFFAOYSA-N 0 0 286.715 4.061 20 5 CIBDRN C[C@H](CSCCc1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000537566973 330442513 /nfs/dbraw/zinc/44/25/13/330442513.db2.gz NGBCTZWDJDPTHI-SECBINFHSA-N 0 0 293.310 4.069 20 5 CIBDRN C[C@@H](SCCC1CC1)c1cccc([N+](=O)[O-])c1 ZINC000437924173 330711146 /nfs/dbraw/zinc/71/11/46/330711146.db2.gz YCFCEZBHJCFYOF-SNVBAGLBSA-N 0 0 251.351 4.189 20 5 CIBDRN O=[N+]([O-])c1cccnc1SCc1cc(F)ccc1Cl ZINC000438306407 330721279 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ZINC000447587136 330871748 /nfs/dbraw/zinc/87/17/48/330871748.db2.gz OXGWYCFEZUWKDQ-QGZVFWFLSA-N 0 0 282.343 4.393 20 5 CIBDRN Cc1cc(-c2noc([C@H]3CC34CCCC4)n2)cc([N+](=O)[O-])c1 ZINC000453282331 331110713 /nfs/dbraw/zinc/11/07/13/331110713.db2.gz DYOXQAKMBQIHSY-CYBMUJFWSA-N 0 0 299.330 4.001 20 5 CIBDRN O=[N+]([O-])c1cnc(Oc2cc(Cl)ccc2Cl)s1 ZINC000195505384 331175575 /nfs/dbraw/zinc/17/55/75/331175575.db2.gz DKGHLAUIHFVFLC-UHFFFAOYSA-N 0 0 291.115 4.150 20 5 CIBDRN CC(=O)c1ccc(NC2CCC(C)(C)CC2)c([N+](=O)[O-])c1 ZINC000462869400 331333314 /nfs/dbraw/zinc/33/33/14/331333314.db2.gz AJSGJXVKPYHOBZ-UHFFFAOYSA-N 0 0 290.363 4.178 20 5 CIBDRN Cc1cc(N2CCC3(C2)CCCCC3)ccc1[N+](=O)[O-] ZINC000462915157 331335033 /nfs/dbraw/zinc/33/50/33/331335033.db2.gz UOBQMHPGNXXYCN-UHFFFAOYSA-N 0 0 274.364 4.064 20 5 CIBDRN O=[N+]([O-])c1cnc(N[C@@H]2CC[C@@H]3CCC[C@H]3C2)c(Cl)c1 ZINC000462916185 331335069 /nfs/dbraw/zinc/33/50/69/331335069.db2.gz ZFEVNNJUQPJKBO-GARJFASQSA-N 0 0 295.770 4.024 20 5 CIBDRN O=[N+]([O-])c1ccccc1Nc1cccc(CC(F)(F)F)c1 ZINC000462928010 331335255 /nfs/dbraw/zinc/33/52/55/331335255.db2.gz QPJLJGAWTGWDQC-UHFFFAOYSA-N 0 0 296.248 4.443 20 5 CIBDRN CC[C@H](c1ccccc1)N(CC)c1ncc(C)cc1[N+](=O)[O-] ZINC000463051710 331338756 /nfs/dbraw/zinc/33/87/56/331338756.db2.gz ADGNFZWEQRXEMC-OAHLLOKOSA-N 0 0 299.374 4.276 20 5 CIBDRN CCC[C@H](Nc1ncc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000463059054 331339091 /nfs/dbraw/zinc/33/90/91/331339091.db2.gz ZCCIOZZOPWVGSS-AWEZNQCLSA-N 0 0 285.347 4.252 20 5 CIBDRN Cc1ccc(CC[C@@H](C)Nc2ccc(F)cc2[N+](=O)[O-])o1 ZINC000463074642 331339512 /nfs/dbraw/zinc/33/95/12/331339512.db2.gz TXPQSVVKSRJFDR-SNVBAGLBSA-N 0 0 292.310 4.069 20 5 CIBDRN CC(C)[C@@H](C)SCc1c(F)cccc1[N+](=O)[O-] ZINC000463227746 331343104 /nfs/dbraw/zinc/34/31/04/331343104.db2.gz BRMRBGNXNWLJLL-SECBINFHSA-N 0 0 257.330 4.012 20 5 CIBDRN O=[N+]([O-])c1cccc(F)c1OCc1ccc(F)cc1Cl ZINC000463571916 331349654 /nfs/dbraw/zinc/34/96/54/331349654.db2.gz SRLUKKIFNMKITI-UHFFFAOYSA-N 0 0 299.660 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CIBDRN CCc1cc(NC(=O)c2c(C)cccc2[N+](=O)[O-])ccc1C ZINC000192456271 333235769 /nfs/dbraw/zinc/23/57/69/333235769.db2.gz UYDGLKLPABCXMF-UHFFFAOYSA-N 0 0 298.342 4.026 20 5 CIBDRN Cc1ccc(CNc2ccc3ncsc3c2)cc1[N+](=O)[O-] ZINC000226651287 333267127 /nfs/dbraw/zinc/26/71/27/333267127.db2.gz LSXIGNRHIBTHPD-UHFFFAOYSA-N 0 0 299.355 4.125 20 5 CIBDRN O=[N+]([O-])c1ccc(N[C@@H](Cc2ccccc2)C2CC2)cc1 ZINC000522980026 333302940 /nfs/dbraw/zinc/30/29/40/333302940.db2.gz DBLVKPACGDKEFL-KRWDZBQOSA-N 0 0 282.343 4.028 20 5 CIBDRN CC[C@H](Nc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000523087762 333307670 /nfs/dbraw/zinc/30/76/70/333307670.db2.gz YZAQJGONCNOYIC-ZDUSSCGKSA-N 0 0 292.285 4.436 20 5 CIBDRN C[C@H](Oc1ccccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000302755939 333335071 /nfs/dbraw/zinc/33/50/71/333335071.db2.gz KRBXHXUZHCZJFW-JTQLQIEISA-N 0 0 277.707 4.388 20 5 CIBDRN C[C@@H](N(C)c1ccc2cc([N+](=O)[O-])ccc2n1)C(C)(C)C ZINC000523658523 333335619 /nfs/dbraw/zinc/33/56/19/333335619.db2.gz 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Cc1cccc([N+](=O)[O-])c1N[C@H]1CSc2ccccc21 ZINC000547959881 334131645 /nfs/dbraw/zinc/13/16/45/334131645.db2.gz IKGZFUUAWKMRPT-LBPRGKRZSA-N 0 0 286.356 4.162 20 5 CIBDRN CCCCN(CCCC)C(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000078346768 334131682 /nfs/dbraw/zinc/13/16/82/334131682.db2.gz YPHJZVWASSBAAI-UHFFFAOYSA-N 0 0 298.408 4.007 20 5 CIBDRN O=[N+]([O-])c1ccc(SCc2cccc(F)c2Cl)nc1 ZINC000549055732 334184158 /nfs/dbraw/zinc/18/41/58/334184158.db2.gz FQARLGBCIOCRKW-UHFFFAOYSA-N 0 0 298.726 4.075 20 5 CIBDRN CC[C@@H](CC(F)(F)F)Nc1cccc(C)c1[N+](=O)[O-] ZINC000549556973 334198012 /nfs/dbraw/zinc/19/80/12/334198012.db2.gz XNSPWVNPAGMJPQ-VIFPVBQESA-N 0 0 276.258 4.046 20 5 CIBDRN O=[N+]([O-])c1ccc(OCc2sccc2Cl)c(F)c1 ZINC000549624543 334199925 /nfs/dbraw/zinc/19/99/25/334199925.db2.gz SHHWNXQHQDVGHS-UHFFFAOYSA-N 0 0 287.699 4.028 20 5 CIBDRN CC(=O)c1cc(NCc2ccc(C)cc2C)ccc1[N+](=O)[O-] ZINC000552959341 334353108 /nfs/dbraw/zinc/35/31/08/334353108.db2.gz ZKDFHLPEMOOMPY-UHFFFAOYSA-N 0 0 298.342 4.026 20 5 CIBDRN C/C=C/c1ccc(NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000554719446 334448212 /nfs/dbraw/zinc/44/82/12/334448212.db2.gz UTSZWPJRRPJWPS-NSCUHMNNSA-N 0 0 268.316 4.240 20 5 CIBDRN CCC[C@@H](C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C)C(C)C ZINC000153454982 334604973 /nfs/dbraw/zinc/60/49/73/334604973.db2.gz FGEFCIDTHNLRTC-CYBMUJFWSA-N 0 0 292.379 4.222 20 5 CIBDRN Cc1cc([N+](=O)[O-])ccc1-c1noc(C2CC3(CCC3)C2)n1 ZINC000567853659 334768713 /nfs/dbraw/zinc/76/87/13/334768713.db2.gz JVFOTXATHWRNGE-UHFFFAOYSA-N 0 0 299.330 4.001 20 5 CIBDRN CCCC(CCC)Sc1c([N+](=O)[O-])nc(C)n1CC ZINC000568908694 334846364 /nfs/dbraw/zinc/84/63/64/334846364.db2.gz UXPRKNVBFBVFIX-UHFFFAOYSA-N 0 0 285.413 4.181 20 5 CIBDRN Cc1cccc(SCc2csc([N+](=O)[O-])c2)c1 ZINC000577210319 335323120 /nfs/dbraw/zinc/32/31/20/335323120.db2.gz BKWSOGJYDUVMGH-UHFFFAOYSA-N 0 0 265.359 4.257 20 5 CIBDRN C[C@H](Nc1cc(C2CC2)ccn1)c1cccc([N+](=O)[O-])c1 ZINC000353578755 534015221 /nfs/dbraw/zinc/01/52/21/534015221.db2.gz SDELWAIHBPHXPD-NSHDSACASA-N 0 0 283.331 4.040 20 5 CIBDRN Cc1nc(N[C@H](C)c2cc3ccccc3o2)ccc1[N+](=O)[O-] ZINC000301649865 534497462 /nfs/dbraw/zinc/49/74/62/534497462.db2.gz PMVUZGUOQXWCCS-LLVKDONJSA-N 0 0 297.314 4.218 20 5 CIBDRN Cc1cnc(Oc2cc(C)cc(C)c2C)c([N+](=O)[O-])c1 ZINC000301446509 534599412 /nfs/dbraw/zinc/59/94/12/534599412.db2.gz OEJHZJZBXFJPMU-UHFFFAOYSA-N 0 0 272.304 4.016 20 5 CIBDRN Cc1cccc([C@@H](C)Nc2nccc(C)c2[N+](=O)[O-])c1C ZINC000301251127 534756929 /nfs/dbraw/zinc/75/69/29/534756929.db2.gz CBIMJFUHSKPDON-CYBMUJFWSA-N 0 0 285.347 4.088 20 5 CIBDRN Cc1ccc(C)c(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000058482239 524088455 /nfs/dbraw/zinc/08/84/55/524088455.db2.gz DPNKULJJTSEPQX-UHFFFAOYSA-N 0 0 295.294 4.189 20 5 CIBDRN Cc1cc(N[C@@H](C)c2ccc(F)cc2F)ccc1[N+](=O)[O-] ZINC000042246493 525293541 /nfs/dbraw/zinc/29/35/41/525293541.db2.gz IJECVMKIPCSXAV-JTQLQIEISA-N 0 0 292.285 4.355 20 5 CIBDRN C[C@H](NCc1ccc([N+](=O)[O-])cc1Cl)c1ccsc1 ZINC000061362628 525451274 /nfs/dbraw/zinc/45/12/74/525451274.db2.gz CIRFZNBMGZZTOP-VIFPVBQESA-N 0 0 296.779 4.161 20 5 CIBDRN O=[N+]([O-])c1ccc(SC2CCCC2)cc1OC(F)F ZINC000301920455 534883190 /nfs/dbraw/zinc/88/31/90/534883190.db2.gz FBCQULYUNJOTEV-UHFFFAOYSA-N 0 0 289.303 4.231 20 5 CIBDRN Cc1ccc([C@H](C)Nc2ccccc2[N+](=O)[O-])s1 ZINC000037058955 525950120 /nfs/dbraw/zinc/95/01/20/525950120.db2.gz ZIAVQQMGMSXBNL-JTQLQIEISA-N 0 0 262.334 4.138 20 5 CIBDRN Cc1noc(C)c1CS[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000266312466 526528391 /nfs/dbraw/zinc/52/83/91/526528391.db2.gz DLWZTIFLNUEVQD-NSHDSACASA-N 0 0 292.360 4.194 20 5 CIBDRN Cc1nc(CS[C@H](C)c2ccccc2[N+](=O)[O-])cs1 ZINC000266368686 526914923 /nfs/dbraw/zinc/91/49/23/526914923.db2.gz UJICREWMKGPWCD-SECBINFHSA-N 0 0 294.401 4.354 20 5 CIBDRN CC[C@@H](Nc1ccc(F)cc1[N+](=O)[O-])c1nc(C)cs1 ZINC000301177009 529209891 /nfs/dbraw/zinc/20/98/91/529209891.db2.gz MHRHXJHFHZMNKB-SNVBAGLBSA-N 0 0 295.339 4.062 20 5 CIBDRN C[C@@H](SCc1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000096957142 185141025 /nfs/dbraw/zinc/14/10/25/185141025.db2.gz UXQDBKOZHBFNLL-SNVBAGLBSA-N 0 0 263.318 4.182 20 5 CIBDRN O=[N+]([O-])c1ccccc1CSCCCC1CCOCC1 ZINC000573669604 334956080 /nfs/dbraw/zinc/95/60/80/334956080.db2.gz JMVNRIATGXJHFQ-UHFFFAOYSA-N 0 0 295.404 4.035 20 5 CIBDRN Cc1ccc(Cl)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000088765155 260001628 /nfs/dbraw/zinc/00/16/28/260001628.db2.gz ZCRKSXCWJZFRLK-UHFFFAOYSA-N 0 0 277.707 4.136 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)SCc1cccnc1 ZINC000342003331 130192983 /nfs/dbraw/zinc/19/29/83/130192983.db2.gz LFLHVDJVKDJIPU-GFCCVEGCSA-N 0 0 288.372 4.293 20 5 CIBDRN CC(C)c1ccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000006346902 170194627 /nfs/dbraw/zinc/19/46/27/170194627.db2.gz HOELQCBPXKYHAU-UHFFFAOYSA-N 0 0 299.330 4.362 20 5 CIBDRN CCc1ccccc1N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000019984942 170960634 /nfs/dbraw/zinc/96/06/34/170960634.db2.gz SZKWKLRTXFXKFY-GFCCVEGCSA-N 0 0 270.332 4.330 20 5 CIBDRN Cc1ccc(N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000020092779 170991870 /nfs/dbraw/zinc/99/18/70/170991870.db2.gz LKOWADRONCKTFO-GFCCVEGCSA-N 0 0 256.305 4.076 20 5 CIBDRN C[C@H](Nc1ccc(Cl)cc1)c1ccccc1[N+](=O)[O-] ZINC000020526039 171239012 /nfs/dbraw/zinc/23/90/12/171239012.db2.gz VSDVRLPVRIIRAL-JTQLQIEISA-N 0 0 276.723 4.421 20 5 CIBDRN CCC(CC)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000037754782 173678570 /nfs/dbraw/zinc/67/85/70/173678570.db2.gz MYAWGRARLRVVLC-UHFFFAOYSA-N 0 0 276.258 4.214 20 5 CIBDRN CC[C@@H](Oc1cccnc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000070766366 176005091 /nfs/dbraw/zinc/00/50/91/176005091.db2.gz RXUSJJRZALMCSE-GFCCVEGCSA-N 0 0 292.722 4.173 20 5 CIBDRN Cc1cccc(Cl)c1OCc1cccc([N+](=O)[O-])c1 ZINC000078805411 177390527 /nfs/dbraw/zinc/39/05/27/177390527.db2.gz QURARNRQYJBRFY-UHFFFAOYSA-N 0 0 277.707 4.136 20 5 CIBDRN Cc1ccc(Oc2ncc([N+](=O)[O-])cc2Cl)cc1C ZINC000301289707 227500834 /nfs/dbraw/zinc/50/08/34/227500834.db2.gz SUVALUWSYOQBRH-UHFFFAOYSA-N 0 0 278.695 4.052 20 5 CIBDRN O=[N+]([O-])c1cccnc1Nc1cccc(NC2CCCC2)c1 ZINC000301300581 227505948 /nfs/dbraw/zinc/50/59/48/227505948.db2.gz UUSLZNZRFMVJRJ-UHFFFAOYSA-N 0 0 298.346 4.088 20 5 CIBDRN Cc1ccnc(S[C@@H](C)c2ccc(F)cc2)c1[N+](=O)[O-] ZINC000301302124 227506397 /nfs/dbraw/zinc/50/63/97/227506397.db2.gz RPOZPBBNVZSBBA-JTQLQIEISA-N 0 0 292.335 4.291 20 5 CIBDRN Cc1ccc([C@H]2CCCN2c2ccccc2[N+](=O)[O-])s1 ZINC000301308268 227508643 /nfs/dbraw/zinc/50/86/43/227508643.db2.gz WKMRYDDIWYKUFD-CQSZACIVSA-N 0 0 288.372 4.306 20 5 CIBDRN Cc1cc(Oc2ccc(Cl)cc2Cl)ncc1[N+](=O)[O-] ZINC000301437355 227538391 /nfs/dbraw/zinc/53/83/91/227538391.db2.gz SKSLZGDBNHKJHY-UHFFFAOYSA-N 0 0 299.113 4.397 20 5 CIBDRN Cc1ccc(Oc2ncc(Cl)cc2[N+](=O)[O-])c(Cl)c1 ZINC000301756033 227665673 /nfs/dbraw/zinc/66/56/73/227665673.db2.gz XZRIRCJWYAOSCC-UHFFFAOYSA-N 0 0 299.113 4.397 20 5 CIBDRN O=[N+]([O-])c1cc(Cl)ccc1NCCC[C@H]1CCCCO1 ZINC000302235879 227829851 /nfs/dbraw/zinc/82/98/51/227829851.db2.gz VFSUDCXMBTYWTM-GFCCVEGCSA-N 0 0 298.770 4.009 20 5 CIBDRN O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(Cl)nc1 ZINC000302751449 227883372 /nfs/dbraw/zinc/88/33/72/227883372.db2.gz HFPNUXJOBUFIIX-UHFFFAOYSA-N 0 0 285.086 4.089 20 5 CIBDRN O=[N+]([O-])c1ccccc1OCc1ccc(C(F)F)cc1 ZINC000185774310 260011659 /nfs/dbraw/zinc/01/16/59/260011659.db2.gz XVEURGCPRBQCDN-UHFFFAOYSA-N 0 0 279.242 4.111 20 5 CIBDRN Cc1cc(N[C@H](C)c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000312613802 260182737 /nfs/dbraw/zinc/18/27/37/260182737.db2.gz UJRKIZRNBFASAT-LLVKDONJSA-N 0 0 274.295 4.215 20 5 CIBDRN CCc1ccc([C@H](C)Nc2cc(C)c([N+](=O)[O-])cn2)cc1 ZINC000092026825 260266998 /nfs/dbraw/zinc/26/69/98/260266998.db2.gz FXXKYWVFLJQYAA-LBPRGKRZSA-N 0 0 285.347 4.034 20 5 CIBDRN Cc1cccc(Cl)c1NCc1cccc([N+](=O)[O-])c1 ZINC000090496888 260363302 /nfs/dbraw/zinc/36/33/02/260363302.db2.gz TVOKSBICZDUIGK-UHFFFAOYSA-N 0 0 276.723 4.169 20 5 CIBDRN Cc1cc([C@H](C)Nc2c(F)cccc2[N+](=O)[O-])c(C)o1 ZINC000132457335 260499479 /nfs/dbraw/zinc/49/94/79/260499479.db2.gz HTBMDJWHYRADDZ-VIFPVBQESA-N 0 0 278.283 4.117 20 5 CIBDRN CC[C@H](Nc1ccc([N+](=O)[O-])cn1)c1ccc(Cl)s1 ZINC000426900532 260543134 /nfs/dbraw/zinc/54/31/34/260543134.db2.gz IKFKOZSDHXLSDM-VIFPVBQESA-N 0 0 297.767 4.268 20 5 CIBDRN CCO[C@@H](C)c1nc(-c2ccc(C)c([N+](=O)[O-])c2)cs1 ZINC000174099753 261179207 /nfs/dbraw/zinc/17/92/07/261179207.db2.gz GLTZKJCSPDETHW-JTQLQIEISA-N 0 0 292.360 4.124 20 5 CIBDRN Cc1nc(CS[C@H](C)c2cccc([N+](=O)[O-])c2)cs1 ZINC000105637223 261314113 /nfs/dbraw/zinc/31/41/13/261314113.db2.gz JVWFOHADNRVVLH-SECBINFHSA-N 0 0 294.401 4.354 20 5 CIBDRN O=[N+]([O-])c1ccc(NCC2(C3CC3)CCC2)c2ccncc21 ZINC000301813510 261343142 /nfs/dbraw/zinc/34/31/42/261343142.db2.gz YRHYQNVSQMWKDG-UHFFFAOYSA-N 0 0 297.358 4.135 20 5 CIBDRN Cc1cc(NC2CCC(F)(F)CC2)c(F)cc1[N+](=O)[O-] ZINC000390069569 262103549 /nfs/dbraw/zinc/10/35/49/262103549.db2.gz UAVNOYZNBNDRNV-UHFFFAOYSA-N 0 0 288.269 4.032 20 5 CIBDRN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccccc1C(C)C ZINC000497532574 262173473 /nfs/dbraw/zinc/17/34/73/262173473.db2.gz JUYGPTLLPOMGIC-UHFFFAOYSA-N 0 0 298.342 4.279 20 5 CIBDRN Cc1ccc(N[C@@H](C)c2ccccc2[N+](=O)[O-])cc1F ZINC000020526089 262245254 /nfs/dbraw/zinc/24/52/54/262245254.db2.gz YLIKZKDUSZXJGQ-NSHDSACASA-N 0 0 274.295 4.215 20 5 CIBDRN Cc1ccc(N[C@@H](C)c2ccccc2[N+](=O)[O-])cc1C ZINC000020526032 262245339 /nfs/dbraw/zinc/24/53/39/262245339.db2.gz DVHWUANMGUGWJS-ZDUSSCGKSA-N 0 0 270.332 4.385 20 5 CIBDRN O=[N+]([O-])c1ccc2nc(/C=C/c3ccc(O)cc3)ccc2c1 ZINC000184767199 262298470 /nfs/dbraw/zinc/29/84/70/262298470.db2.gz IZMXLHQNPNEKIT-ORCRQEGFSA-N 0 0 292.294 4.019 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CCCCC1(C)C ZINC000436273141 262802202 /nfs/dbraw/zinc/80/22/02/262802202.db2.gz ILZKCPILKQYUMR-CYBMUJFWSA-N 0 0 290.363 4.058 20 5 CIBDRN COc1ccc([C@H](C)Nc2cc(C)ccc2[N+](=O)[O-])cc1 ZINC000094659799 265249035 /nfs/dbraw/zinc/24/90/35/265249035.db2.gz DMQNFUQNCUDTOU-LBPRGKRZSA-N 0 0 286.331 4.085 20 5 CIBDRN C/C=C/c1ccc(NCc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000519128513 265328475 /nfs/dbraw/zinc/32/84/75/265328475.db2.gz XAVLTXHGWGSOFY-ONEGZZNKSA-N 0 0 298.342 4.249 20 5 CIBDRN CC1(C)CC[C@@H](Nc2ncccc2[N+](=O)[O-])c2ccccc21 ZINC000519887805 265641554 /nfs/dbraw/zinc/64/15/54/265641554.db2.gz QFBKPFDYUFMICY-CQSZACIVSA-N 0 0 297.358 4.214 20 5 CIBDRN Cc1cnc(NCc2ccc(C(C)C)c([N+](=O)[O-])c2)s1 ZINC000352009495 265930961 /nfs/dbraw/zinc/93/09/61/265930961.db2.gz VVLSBDLZARTNPW-UHFFFAOYSA-N 0 0 291.376 4.095 20 5 CIBDRN Cc1cccc(OCc2ccc(C(F)F)cc2)c1[N+](=O)[O-] ZINC000460673680 327787514 /nfs/dbraw/zinc/78/75/14/327787514.db2.gz PYZGHNMWSQYNGZ-UHFFFAOYSA-N 0 0 293.269 4.420 20 5 CIBDRN O=[N+]([O-])c1cc(F)ccc1N[C@@H](c1ccccc1)C1CC1 ZINC000041064181 328025458 /nfs/dbraw/zinc/02/54/58/328025458.db2.gz HJAXFKAKLKXTSQ-INIZCTEOSA-N 0 0 286.306 4.297 20 5 CIBDRN CCc1ccc(CNc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000048336440 328053443 /nfs/dbraw/zinc/05/34/43/328053443.db2.gz SHRPAAMRZBKFKK-UHFFFAOYSA-N 0 0 296.779 4.484 20 5 CIBDRN Cc1cc2cc(Nc3ccccc3[N+](=O)[O-])ccc2[nH]1 ZINC000048462335 328313552 /nfs/dbraw/zinc/31/35/52/328313552.db2.gz CSTXPNGQQFNADK-UHFFFAOYSA-N 0 0 267.288 4.128 20 5 CIBDRN O=[N+]([O-])c1cc(F)c(CNc2ccccc2Cl)c(F)c1 ZINC000506271817 332768122 /nfs/dbraw/zinc/76/81/22/332768122.db2.gz YKHSMNITGXZYBW-UHFFFAOYSA-N 0 0 298.676 4.139 20 5 CIBDRN Cc1cc(C)cc(NCc2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000111333184 328346910 /nfs/dbraw/zinc/34/69/10/328346910.db2.gz RIIKWZPRFRHXGG-UHFFFAOYSA-N 0 0 290.750 4.477 20 5 CIBDRN C[C@H](NCc1c(Cl)cccc1[N+](=O)[O-])c1cccs1 ZINC000111333492 328347265 /nfs/dbraw/zinc/34/72/65/328347265.db2.gz DYULHEPLDSBQDR-VIFPVBQESA-N 0 0 296.779 4.161 20 5 CIBDRN COc1ccccc1Sc1ccc([N+](=O)[O-])cc1Cl ZINC000049389810 328357110 /nfs/dbraw/zinc/35/71/10/328357110.db2.gz TXUXSSBFKSRNGZ-UHFFFAOYSA-N 0 0 295.747 4.408 20 5 CIBDRN CCc1nccn1Cc1nc2ccccc2c2ccccc12 ZINC000535234852 328396450 /nfs/dbraw/zinc/39/64/50/328396450.db2.gz VGDXJCNPKQLSEV-UHFFFAOYSA-N 0 0 287.366 4.195 20 5 CIBDRN C[C@@H](NCc1ccccc1[N+](=O)[O-])c1csc(Cl)c1 ZINC000191350649 328599699 /nfs/dbraw/zinc/59/96/99/328599699.db2.gz YWAOEGQJGINWIK-SECBINFHSA-N 0 0 296.779 4.161 20 5 CIBDRN CCn1c(C)nc([N+](=O)[O-])c1Oc1ccc2ccccc2c1 ZINC000584193293 327064248 /nfs/dbraw/zinc/06/42/48/327064248.db2.gz IKULUUGHFNCTMG-UHFFFAOYSA-N 0 0 297.314 4.065 20 5 CIBDRN O=[N+]([O-])c1cccc(SCc2ccc3ncccc3c2)c1 ZINC000558687224 327114077 /nfs/dbraw/zinc/11/40/77/327114077.db2.gz DHXIDUIYWCUIEK-UHFFFAOYSA-N 0 0 296.351 4.435 20 5 CIBDRN CCOc1cccc(N[C@@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000569355593 327161385 /nfs/dbraw/zinc/16/13/85/327161385.db2.gz RUNAVPHVWNTRCA-MRXNPFEDSA-N 0 0 298.342 4.093 20 5 CIBDRN Cc1cc(F)cc(NCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000091513432 327170775 /nfs/dbraw/zinc/17/07/75/327170775.db2.gz MLKSLQFXSIPNRP-UHFFFAOYSA-N 0 0 294.713 4.308 20 5 CIBDRN CC(=O)c1cc(NCCC2=CCCCC2)ccc1[N+](=O)[O-] ZINC000561097620 327366047 /nfs/dbraw/zinc/36/60/47/327366047.db2.gz BAWCAWYONXLFLI-UHFFFAOYSA-N 0 0 288.347 4.100 20 5 CIBDRN O=[N+]([O-])c1ccccc1SCc1c(F)cccc1F ZINC000564561429 327525583 /nfs/dbraw/zinc/52/55/83/327525583.db2.gz BEUCZCXNNBZUHG-UHFFFAOYSA-N 0 0 281.283 4.165 20 5 CIBDRN Cc1cc(N[C@H](C)c2c(F)cccc2F)ccc1[N+](=O)[O-] ZINC000042253068 328763313 /nfs/dbraw/zinc/76/33/13/328763313.db2.gz VVNDMIVKIPTDAF-SNVBAGLBSA-N 0 0 292.285 4.355 20 5 CIBDRN CC[C@@H](Nc1cc(C)c([N+](=O)[O-])cn1)c1ccc(C)cc1 ZINC000301434075 328828005 /nfs/dbraw/zinc/82/80/05/328828005.db2.gz QOLJAPIKKKTCIT-CQSZACIVSA-N 0 0 285.347 4.170 20 5 CIBDRN Cc1csc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000394236377 329108252 /nfs/dbraw/zinc/10/82/52/329108252.db2.gz PRFOMODUVYMMTA-GFCCVEGCSA-N 0 0 290.388 4.124 20 5 CIBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCCC[C@@H]2c2ccccc2)cn1 ZINC000582868926 329278607 /nfs/dbraw/zinc/27/86/07/329278607.db2.gz NRSOPECTVWTXNV-HZPDHXFCSA-N 0 0 297.358 4.128 20 5 CIBDRN C[C@@H]1C[C@@H](C)N1C(=O)c1cc2ccccc2c2cccnc12 ZINC000525940729 329398094 /nfs/dbraw/zinc/39/80/94/329398094.db2.gz 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ZINC000163485539 331046202 /nfs/dbraw/zinc/04/62/02/331046202.db2.gz XYSGAAMMPCDFBD-JTQLQIEISA-N 0 0 290.285 4.436 20 5 CIBDRN Cc1c(-c2noc([C@H](C)C(C)(C)C)n2)cccc1[N+](=O)[O-] ZINC000453252573 331107865 /nfs/dbraw/zinc/10/78/65/331107865.db2.gz JBGSGDCRATVQPR-JTQLQIEISA-N 0 0 289.335 4.103 20 5 CIBDRN CC[C@H](CC(F)(F)F)Nc1cc(C)c([N+](=O)[O-])cc1F ZINC000461940002 331315816 /nfs/dbraw/zinc/31/58/16/331315816.db2.gz ZPYLQSRUEWYMPM-MRVPVSSYSA-N 0 0 294.248 4.185 20 5 CIBDRN Cc1cc(Oc2cnc3ccccc3c2)c(F)cc1[N+](=O)[O-] ZINC000461941386 331315864 /nfs/dbraw/zinc/31/58/64/331315864.db2.gz OLYGHHOGTKTVDW-UHFFFAOYSA-N 0 0 298.273 4.383 20 5 CIBDRN Cc1cccc2c(CCNc3ccccc3[N+](=O)[O-])c[nH]c21 ZINC000462868827 331333316 /nfs/dbraw/zinc/33/33/16/331333316.db2.gz SQPWARLLZAWDIS-UHFFFAOYSA-N 0 0 295.342 4.039 20 5 CIBDRN C[C@@H]1CCC[C@@H](C)N(c2ccc([N+](=O)[O-])c3cnccc32)C1 ZINC000462871281 331333386 /nfs/dbraw/zinc/33/33/86/331333386.db2.gz HPHRFKRPDDABMW-CHWSQXEVSA-N 0 0 299.374 4.158 20 5 CIBDRN C[C@H]1CCC[C@H](C)N(c2ccc([N+](=O)[O-])c3cnccc32)C1 ZINC000462871284 331333396 /nfs/dbraw/zinc/33/33/96/331333396.db2.gz HPHRFKRPDDABMW-STQMWFEESA-N 0 0 299.374 4.158 20 5 CIBDRN C[C@@H]1CCC[C@H](C)N(c2ccc([N+](=O)[O-])c3cnccc32)C1 ZINC000462871282 331333454 /nfs/dbraw/zinc/33/34/54/331333454.db2.gz HPHRFKRPDDABMW-OLZOCXBDSA-N 0 0 299.374 4.158 20 5 CIBDRN O=[N+]([O-])c1ccccc1Nc1ccc(CC(F)(F)F)cc1 ZINC000462874657 331333554 /nfs/dbraw/zinc/33/35/54/331333554.db2.gz QQEMVQNKNKYZOJ-UHFFFAOYSA-N 0 0 296.248 4.443 20 5 CIBDRN CC(C)C1CCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000462911419 331334837 /nfs/dbraw/zinc/33/48/37/331334837.db2.gz KBHROELADUZIGY-UHFFFAOYSA-N 0 0 299.374 4.015 20 5 CIBDRN CC[C@]1(C)CCCN(c2ccc3cc([N+](=O)[O-])ccc3n2)C1 ZINC000462942599 331335530 /nfs/dbraw/zinc/33/55/30/331335530.db2.gz UZMMFMQPZQVOMQ-QGZVFWFLSA-N 0 0 299.374 4.160 20 5 CIBDRN Cc1ccc([C@H](C)Nc2ncc(C)cc2[N+](=O)[O-])c(C)c1 ZINC000463047186 331338544 /nfs/dbraw/zinc/33/85/44/331338544.db2.gz 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Cc1ccccc1[C@@H](CC(C)C)Nc1ccc([N+](=O)[O-])cn1 ZINC000488211811 331994074 /nfs/dbraw/zinc/99/40/74/331994074.db2.gz WGUYMLSYPRHJIP-MRXNPFEDSA-N 0 0 299.374 4.498 20 5 CIBDRN CC(C)c1ccc2c(c1)[C@@H](Nc1ccc([N+](=O)[O-])nc1)CC2 ZINC000490051406 332078770 /nfs/dbraw/zinc/07/87/70/332078770.db2.gz VVAPTGKGSSOEEK-INIZCTEOSA-N 0 0 297.358 4.213 20 5 CIBDRN O=C(Nc1cccc2ccsc21)c1ccc([N+](=O)[O-])cc1 ZINC000501690949 332638798 /nfs/dbraw/zinc/63/87/98/332638798.db2.gz PUUPKTFOCLYBKT-UHFFFAOYSA-N 0 0 298.323 4.062 20 5 CIBDRN CCc1ccc([C@@H](Nc2ccc([N+](=O)[O-])nc2)C(C)C)cc1 ZINC000501902940 332642978 /nfs/dbraw/zinc/64/29/78/332642978.db2.gz BFBGTHYZKXHWCM-KRWDZBQOSA-N 0 0 299.374 4.361 20 5 CIBDRN Cc1cc([C@@H](C)N[C@H](C)c2ccccc2[N+](=O)[O-])oc1C ZINC000502403881 332657022 /nfs/dbraw/zinc/65/70/22/332657022.db2.gz FQOGSNAWIZMMFE-VXGBXAGGSA-N 0 0 288.347 4.216 20 5 CIBDRN Cc1nn(C[C@@H](C)c2ccccc2)c2ccc([N+](=O)[O-])cc12 ZINC000502897256 332675577 /nfs/dbraw/zinc/67/55/77/332675577.db2.gz 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CCCc1ccccc1NCc1csc([N+](=O)[O-])c1 ZINC000037562834 333534930 /nfs/dbraw/zinc/53/49/30/333534930.db2.gz PHYOHBPEGDFLKR-UHFFFAOYSA-N 0 0 276.361 4.221 20 5 CIBDRN CC(=O)c1ccc(Oc2cc(C)c([N+](=O)[O-])cc2F)cc1 ZINC000123492133 333547631 /nfs/dbraw/zinc/54/76/31/333547631.db2.gz ASVYSZIBCGTGJG-UHFFFAOYSA-N 0 0 289.262 4.037 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)SC[C@H]1CCCCO1 ZINC000538703695 333612758 /nfs/dbraw/zinc/61/27/58/333612758.db2.gz VEUSKZVYGBJNSE-TZMCWYRMSA-N 0 0 295.404 4.267 20 5 CIBDRN C[C@@H](Sc1ncccc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000067807312 333644407 /nfs/dbraw/zinc/64/44/07/333644407.db2.gz YWVIEFOOAXCSLU-MRVPVSSYSA-N 0 0 296.298 4.121 20 5 CIBDRN CCc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2C)cc1C ZINC000539896721 333701580 /nfs/dbraw/zinc/70/15/80/333701580.db2.gz PTBOGDJUWPVQFW-UHFFFAOYSA-N 0 0 298.342 4.026 20 5 CIBDRN Cc1ccc(-c2noc([C@H]3CC34CCCC4)n2)cc1[N+](=O)[O-] ZINC000545572313 333989147 /nfs/dbraw/zinc/98/91/47/333989147.db2.gz ZGGCWGRMNYHQLB-GFCCVEGCSA-N 0 0 299.330 4.001 20 5 CIBDRN CCC(CC)c1noc(/C=C\c2cccc([N+](=O)[O-])c2)n1 ZINC000546380204 334030104 /nfs/dbraw/zinc/03/01/04/334030104.db2.gz ILZFNNLGXIHKBG-HJWRWDBZSA-N 0 0 287.319 4.052 20 5 CIBDRN Cc1cccc(OCc2ccc3ncccc3c2)c1[N+](=O)[O-] ZINC000546727298 334048422 /nfs/dbraw/zinc/04/84/22/334048422.db2.gz DOZAKVHZAGAEHF-UHFFFAOYSA-N 0 0 294.310 4.030 20 5 CIBDRN CC(C)(C)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000136117957 334146939 /nfs/dbraw/zinc/14/69/39/334146939.db2.gz UJTHCLMZFVVLTI-UHFFFAOYSA-N 0 0 262.334 4.016 20 5 CIBDRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@@H]1CC=CCC1 ZINC000080119840 334166243 /nfs/dbraw/zinc/16/62/43/334166243.db2.gz YHUQQIAHBJPEKL-SNVBAGLBSA-N 0 0 286.253 4.134 20 5 CIBDRN Cc1ccc(C[C@H](C)Nc2ccccc2[N+](=O)[O-])s1 ZINC000080248334 334168391 /nfs/dbraw/zinc/16/83/91/334168391.db2.gz MRVYTTARXVQNCW-JTQLQIEISA-N 0 0 276.361 4.008 20 5 CIBDRN C[C@H]1CCN(Cc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000549562006 334198168 /nfs/dbraw/zinc/19/81/68/334198168.db2.gz AJURYYQQBQUBEZ-ZDUSSCGKSA-N 0 0 282.343 4.109 20 5 CIBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)CCCC(C)(C)C ZINC000086624415 334313899 /nfs/dbraw/zinc/31/38/99/334313899.db2.gz BSJMUKYDJXPYNP-UHFFFAOYSA-N 0 0 292.379 4.367 20 5 CIBDRN CC(=O)c1cc(NCCCC(C)(C)C)ccc1[N+](=O)[O-] ZINC000553078297 334360260 /nfs/dbraw/zinc/36/02/60/334360260.db2.gz CUJPUOKDNDTMBD-UHFFFAOYSA-N 0 0 278.352 4.036 20 5 CIBDRN Cc1cccc(N[C@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000567178377 334688031 /nfs/dbraw/zinc/68/80/31/334688031.db2.gz GZKSERLSJZHTTM-HNNXBMFYSA-N 0 0 268.316 4.003 20 5 CIBDRN C/C=C/c1ccc(NCc2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000568773461 334840580 /nfs/dbraw/zinc/84/05/80/334840580.db2.gz XKXMWLGVNJXZAQ-ONEGZZNKSA-N 0 0 298.342 4.249 20 5 CIBDRN O=[N+]([O-])c1ccc(CSCCCC2CCOCC2)cc1 ZINC000576341583 335191468 /nfs/dbraw/zinc/19/14/68/335191468.db2.gz FYZDHAILKZSXJQ-UHFFFAOYSA-N 0 0 295.404 4.035 20 5 CIBDRN O=[N+]([O-])c1ccc(CCNc2cccc(C(F)F)c2)cc1 ZINC000184431829 335925515 /nfs/dbraw/zinc/92/55/15/335925515.db2.gz SCOMSNJPHMBFGV-UHFFFAOYSA-N 0 0 292.285 4.187 20 5 CIBDRN O=[N+]([O-])c1cccc(Cl)c1COc1ccc(F)cc1F ZINC000380467553 335987318 /nfs/dbraw/zinc/98/73/18/335987318.db2.gz IGKHRBNOKCUTAX-UHFFFAOYSA-N 0 0 299.660 4.105 20 5 CIBDRN COc1ccccc1SCc1ccc([N+](=O)[O-])cc1F ZINC000383821446 336118319 /nfs/dbraw/zinc/11/83/19/336118319.db2.gz HDGJGYPKXKPKSM-UHFFFAOYSA-N 0 0 293.319 4.035 20 5 CIBDRN O=[N+]([O-])c1ccc(CNc2cccc3ccsc32)cc1 ZINC000386250828 336169187 /nfs/dbraw/zinc/16/91/87/336169187.db2.gz RQKJNVAKWQHEJO-UHFFFAOYSA-N 0 0 284.340 4.422 20 5 CIBDRN Cc1cscc1N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000387279496 336190936 /nfs/dbraw/zinc/19/09/36/336190936.db2.gz VEDUMIBDOUIYQT-SNVBAGLBSA-N 0 0 262.334 4.138 20 5 CIBDRN C[C@@H](CC(C)(C)C)c1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000582010183 336191082 /nfs/dbraw/zinc/19/10/82/336191082.db2.gz ILUNDYXXJKKSCQ-JTQLQIEISA-N 0 0 289.335 4.185 20 5 CIBDRN Cc1cc(Oc2ccc(C=O)cc2Cl)ccc1[N+](=O)[O-] ZINC000163875389 525385020 /nfs/dbraw/zinc/38/50/20/525385020.db2.gz XMNSOANPQQUKIH-UHFFFAOYSA-N 0 0 291.690 4.161 20 5 CIBDRN Cc1cc([C@H](C)Nc2c(F)cc([N+](=O)[O-])cc2F)c(C)o1 ZINC000227889144 525532529 /nfs/dbraw/zinc/53/25/29/525532529.db2.gz WBJTTXGTLRIHBA-QMMMGPOBSA-N 0 0 296.273 4.256 20 5 CIBDRN C[C@H](Nc1ccc([N+](=O)[O-])c2cnccc12)c1ccccc1 ZINC000067949427 525660168 /nfs/dbraw/zinc/66/01/68/525660168.db2.gz JCFRNVISFWJQTC-LBPRGKRZSA-N 0 0 293.326 4.316 20 5 CIBDRN Cc1ccnc(Oc2ccc(Cl)cc2Cl)c1[N+](=O)[O-] ZINC000301273979 525706453 /nfs/dbraw/zinc/70/64/53/525706453.db2.gz IIQYJZIYNAAZDN-UHFFFAOYSA-N 0 0 299.113 4.397 20 5 CIBDRN Cc1nc2cc(CSc3cccc([N+](=O)[O-])c3)ccc2[nH]1 ZINC000337914303 527140407 /nfs/dbraw/zinc/14/04/07/527140407.db2.gz MSVVRUUQNPUNFO-UHFFFAOYSA-N 0 0 299.355 4.072 20 5 CIBDRN O=[N+]([O-])c1cc(Cl)ccc1OCc1cccc(F)c1F ZINC000057542673 527334425 /nfs/dbraw/zinc/33/44/25/527334425.db2.gz VJFRMRNCFNLGRX-UHFFFAOYSA-N 0 0 299.660 4.105 20 5 CIBDRN C[C@@H](Oc1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000096956363 185140827 /nfs/dbraw/zinc/14/08/27/185140827.db2.gz BRCURJYYOIYCCE-SECBINFHSA-N 0 0 279.242 4.013 20 5 CIBDRN C/C=C\c1ccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000573550670 334946306 /nfs/dbraw/zinc/94/63/06/334946306.db2.gz BUYNBDNHRXIPCH-ARJAWSKDSA-N 0 0 296.326 4.189 20 5 CIBDRN C/C=C\c1ccc(NCc2cccc([N+](=O)[O-])c2)cc1 ZINC000574360902 335013501 /nfs/dbraw/zinc/01/35/01/335013501.db2.gz DPTWXCCJCYIIPJ-RQOWECAXSA-N 0 0 268.316 4.240 20 5 CIBDRN Cc1ccc2[nH]c(SCc3ccccc3[N+](=O)[O-])nc2c1 ZINC000006292062 170188640 /nfs/dbraw/zinc/18/86/40/170188640.db2.gz LEHHHWRXEXIKDQ-UHFFFAOYSA-N 0 0 299.355 4.072 20 5 CIBDRN CC(=O)c1ccc(Sc2ccccc2F)c([N+](=O)[O-])c1 ZINC000008063184 170316951 /nfs/dbraw/zinc/31/69/51/170316951.db2.gz ABNZTWOOWVOUSI-UHFFFAOYSA-N 0 0 291.303 4.088 20 5 CIBDRN CC(=O)c1ccc(Oc2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000008080739 170318223 /nfs/dbraw/zinc/31/82/23/170318223.db2.gz WHPUJEGODSKMRE-UHFFFAOYSA-N 0 0 291.690 4.243 20 5 CIBDRN O=[N+]([O-])c1ccc(CNc2cccc3c2CCCC3)cc1 ZINC000020043480 170976783 /nfs/dbraw/zinc/97/67/83/170976783.db2.gz QHIRPDDWQIJSQH-UHFFFAOYSA-N 0 0 282.343 4.086 20 5 CIBDRN CCOc1ccccc1N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000020087358 170988115 /nfs/dbraw/zinc/98/81/15/170988115.db2.gz GOUHWABLLBPHCM-GFCCVEGCSA-N 0 0 286.331 4.167 20 5 CIBDRN O=[N+]([O-])c1ccc(-c2csc(-c3cccc(O)c3)n2)cc1 ZINC000020433031 171198112 /nfs/dbraw/zinc/19/81/12/171198112.db2.gz LVXWDYCBPQDZIQ-UHFFFAOYSA-N 0 0 298.323 4.091 20 5 CIBDRN Cc1cccc(CNc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000030784028 171623357 /nfs/dbraw/zinc/62/33/57/171623357.db2.gz RMTUIFUZPFPCBC-UHFFFAOYSA-N 0 0 276.723 4.169 20 5 CIBDRN C[C@H]1CCCC[C@@H]1Nc1ccc([N+](=O)[O-])c2cccnc12 ZINC000035185768 172040086 /nfs/dbraw/zinc/04/00/86/172040086.db2.gz HQKJWUWRNNLBHY-AAEUAGOBSA-N 0 0 285.347 4.134 20 5 CIBDRN C[C@H]1CCCC[C@H]1Nc1ccc([N+](=O)[O-])c2cccnc12 ZINC000035185770 172040225 /nfs/dbraw/zinc/04/02/25/172040225.db2.gz 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Cc1nc(N[C@H](C)c2ccccc2Cl)ccc1[N+](=O)[O-] ZINC000161502163 261062194 /nfs/dbraw/zinc/06/21/94/261062194.db2.gz IXLVIZGBVNTKNR-SECBINFHSA-N 0 0 291.738 4.125 20 5 CIBDRN Cc1cnc(Oc2ccc3ccccc3c2)c([N+](=O)[O-])c1 ZINC000463054306 261763805 /nfs/dbraw/zinc/76/38/05/261763805.db2.gz QTIKKBXVPHTKJW-UHFFFAOYSA-N 0 0 280.283 4.244 20 5 CIBDRN C[C@@H]1CCCC[C@H]1N(C)c1ccc([N+](=O)[O-])c2cnccc21 ZINC000497551082 262174969 /nfs/dbraw/zinc/17/49/69/262174969.db2.gz ZWLWUUWIQORZHE-IUODEOHRSA-N 0 0 299.374 4.158 20 5 CIBDRN C[C@@H](Nc1ccc2c(c1)CCC2)c1ccccc1[N+](=O)[O-] ZINC000020526007 262244888 /nfs/dbraw/zinc/24/48/88/262244888.db2.gz KKJCUHOGJNDFRD-GFCCVEGCSA-N 0 0 282.343 4.257 20 5 CIBDRN Cc1cccc(N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000020557591 262250931 /nfs/dbraw/zinc/25/09/31/262250931.db2.gz OYRHARQLWYVNFU-ZDUSSCGKSA-N 0 0 270.332 4.385 20 5 CIBDRN CC(F)(F)c1cccc(NCc2cccc([N+](=O)[O-])c2)c1 ZINC000187569844 263262003 /nfs/dbraw/zinc/26/20/03/263262003.db2.gz 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O=[N+]([O-])c1cc(Cl)ccc1N1CC2(CCC2)[C@H]1C1CC1 ZINC000572086397 329942953 /nfs/dbraw/zinc/94/29/53/329942953.db2.gz LYPZUMWZKWBJFO-CQSZACIVSA-N 0 0 292.766 4.017 20 5 CIBDRN Cc1ccc(NCc2cccc([N+](=O)[O-])c2C)cc1Cl ZINC000035648632 330248144 /nfs/dbraw/zinc/24/81/44/330248144.db2.gz HPGXOKXTUHSLOR-UHFFFAOYSA-N 0 0 290.750 4.477 20 5 CIBDRN Cc1c(Cl)cccc1NCc1cccc([N+](=O)[O-])c1C ZINC000035648660 330248195 /nfs/dbraw/zinc/24/81/95/330248195.db2.gz ONFPEMXSTNIEDA-UHFFFAOYSA-N 0 0 290.750 4.477 20 5 CIBDRN CO[C@H](CS[C@@H](C)c1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000424158228 330305232 /nfs/dbraw/zinc/30/52/32/330305232.db2.gz SWRVOPIITRCPCG-XHDPSFHLSA-N 0 0 295.404 4.122 20 5 CIBDRN C[C@@H](NCc1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 ZINC000107904346 330351672 /nfs/dbraw/zinc/35/16/72/330351672.db2.gz ZOSUIPIONUQUQS-LLVKDONJSA-N 0 0 290.750 4.099 20 5 CIBDRN CC(C)N(Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000533352150 330359348 /nfs/dbraw/zinc/35/93/48/330359348.db2.gz MEBKYOKGVFPLKV-UHFFFAOYSA-N 0 0 276.361 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ZINC000462898512 331334329 /nfs/dbraw/zinc/33/43/29/331334329.db2.gz XCJANHCOPAMUKU-LLVKDONJSA-N 0 0 290.388 4.255 20 5 CIBDRN CC(C)[C@H](C)Sc1ccc([N+](=O)[O-])c2cnccc12 ZINC000463029854 331337655 /nfs/dbraw/zinc/33/76/55/331337655.db2.gz QKFQOGIGJMFUTR-JTQLQIEISA-N 0 0 276.361 4.280 20 5 CIBDRN Cc1cnc(N[C@@H](C)c2ccc(C)c(C)c2)c([N+](=O)[O-])c1 ZINC000463049236 331338619 /nfs/dbraw/zinc/33/86/19/331338619.db2.gz RQGWCEZVLFEGLR-ZDUSSCGKSA-N 0 0 285.347 4.088 20 5 CIBDRN Cc1cnc(N[C@H](c2ccccc2C)C(C)C)c([N+](=O)[O-])c1 ZINC000463059138 331339062 /nfs/dbraw/zinc/33/90/62/331339062.db2.gz XIDUBBJEJJGZCG-INIZCTEOSA-N 0 0 299.374 4.416 20 5 CIBDRN CCC[C@@]1(C)CCCN(c2ncc([N+](=O)[O-])cc2Cl)C1 ZINC000463069186 331339185 /nfs/dbraw/zinc/33/91/85/331339185.db2.gz OUXSWGXXDQBCCM-AWEZNQCLSA-N 0 0 297.786 4.050 20 5 CIBDRN CC[C@H](C)C[C@@H](C)Nc1ccc(C(C)=O)cc1[N+](=O)[O-] ZINC000463072479 331339391 /nfs/dbraw/zinc/33/93/91/331339391.db2.gz VQHATIHQIYVVHG-WDEREUQCSA-N 0 0 278.352 4.034 20 5 CIBDRN COc1ccccc1[C@@H](C)Sc1ccccc1[N+](=O)[O-] ZINC000463079145 331339764 /nfs/dbraw/zinc/33/97/64/331339764.db2.gz WUGOYUBIZMIGSB-LLVKDONJSA-N 0 0 289.356 4.457 20 5 CIBDRN Cc1c(CS[C@@H](C)C(C)C)cccc1[N+](=O)[O-] ZINC000463229626 331343168 /nfs/dbraw/zinc/34/31/68/331343168.db2.gz OGSKMPORLGLQRE-NSHDSACASA-N 0 0 253.367 4.181 20 5 CIBDRN COc1ccc(S[C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000463250308 331344330 /nfs/dbraw/zinc/34/43/30/331344330.db2.gz KIZLFNFQFILXQU-LLVKDONJSA-N 0 0 289.356 4.457 20 5 CIBDRN Cc1cc([N+](=O)[O-])ccc1CNc1ncccc1C(C)C ZINC000466631478 331401003 /nfs/dbraw/zinc/40/10/03/331401003.db2.gz XTLMYRPWWXRYKB-UHFFFAOYSA-N 0 0 285.347 4.034 20 5 CIBDRN CC(C)C[C@H]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000467011687 331410295 /nfs/dbraw/zinc/41/02/95/331410295.db2.gz BEUHFQYWLSNBNU-CYBMUJFWSA-N 0 0 299.374 4.015 20 5 CIBDRN Cc1ccc(C)c([C@H](C)N(C)c2cc(C)c([N+](=O)[O-])cn2)c1 ZINC000470859649 331492712 /nfs/dbraw/zinc/49/27/12/331492712.db2.gz LINCJNBFKQAUAX-AWEZNQCLSA-N 0 0 299.374 4.112 20 5 CIBDRN CCN(Cc1ccc([N+](=O)[O-])cc1)c1ccc2[nH]ccc2c1 ZINC000471817891 331521747 /nfs/dbraw/zinc/52/17/47/331521747.db2.gz WRUXEFCRGVBQKX-UHFFFAOYSA-N 0 0 295.342 4.103 20 5 CIBDRN Cc1ccc(COc2ccc([N+](=O)[O-])c3ncccc23)cc1 ZINC000471872143 331523095 /nfs/dbraw/zinc/52/30/95/331523095.db2.gz OJOCKIFFEHUNBC-UHFFFAOYSA-N 0 0 294.310 4.030 20 5 CIBDRN Cc1cc(OCc2cccc(C(F)F)c2)ccc1[N+](=O)[O-] ZINC000475954032 331649636 /nfs/dbraw/zinc/64/96/36/331649636.db2.gz GAMBIZUQDRLMOP-UHFFFAOYSA-N 0 0 293.269 4.420 20 5 CIBDRN O=[N+]([O-])c1cccnc1SCc1cccc(C(F)F)c1 ZINC000475971450 331650357 /nfs/dbraw/zinc/65/03/57/331650357.db2.gz INHDFJCCYRIDGM-UHFFFAOYSA-N 0 0 296.298 4.220 20 5 CIBDRN O=[N+]([O-])c1ccc(OCC2CC2)c(-c2cccs2)c1 ZINC000477355678 331682538 /nfs/dbraw/zinc/68/25/38/331682538.db2.gz RAAYIFTZHKCPBZ-UHFFFAOYSA-N 0 0 275.329 4.112 20 5 CIBDRN CC[C@@H](C)n1ncc(Nc2ccc([N+](=O)[O-])c(C)c2)c1C ZINC000477693390 331688500 /nfs/dbraw/zinc/68/85/00/331688500.db2.gz LYQKEFKHCHCOGM-LLVKDONJSA-N 0 0 288.351 4.123 20 5 CIBDRN CCC(=O)c1ccc(Sc2ccccc2)c([N+](=O)[O-])c1 ZINC000479852815 331748398 /nfs/dbraw/zinc/74/83/98/331748398.db2.gz RJLFEDACJWKYDJ-UHFFFAOYSA-N 0 0 287.340 4.339 20 5 CIBDRN CCC[C@@](C)(CC)C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000483130547 331859588 /nfs/dbraw/zinc/85/95/88/331859588.db2.gz XLSXGHPGRPZIFN-OAHLLOKOSA-N 0 0 278.352 4.058 20 5 CIBDRN O=[N+]([O-])c1cc(Cl)ccc1NC[C@@H]1CCC(F)(F)C1 ZINC000485399333 331913474 /nfs/dbraw/zinc/91/34/74/331913474.db2.gz BNJMBIDAFBFKMR-MRVPVSSYSA-N 0 0 290.697 4.096 20 5 CIBDRN Cc1cc([N+](=O)[O-])ccc1CNc1ccc2scnc2c1 ZINC000486910676 331949342 /nfs/dbraw/zinc/94/93/42/331949342.db2.gz XZZCCDNNLYDLLB-UHFFFAOYSA-N 0 0 299.355 4.125 20 5 CIBDRN Cc1ccc2c(c1)[C@H](Nc1ccc([N+](=O)[O-])c(C)n1)CCC2 ZINC000488745447 332023610 /nfs/dbraw/zinc/02/36/10/332023610.db2.gz AXNZPMRBYZUOTD-OAHLLOKOSA-N 0 0 297.358 4.096 20 5 CIBDRN C/C=C\c1ccc(NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000554719445 334448318 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CCOc1ccc(Nc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000514071924 333063982 /nfs/dbraw/zinc/06/39/82/333063982.db2.gz VPSAYJDZPULLHB-UHFFFAOYSA-N 0 0 272.304 4.046 20 5 CIBDRN Cc1ccsc1CNc1cc(C)c([N+](=O)[O-])cc1F ZINC000312102231 333076578 /nfs/dbraw/zinc/07/65/78/333076578.db2.gz IFDSVFCZEHBBGP-UHFFFAOYSA-N 0 0 280.324 4.024 20 5 CIBDRN CC(=O)c1cc(NCC2(CC(C)C)CC2)ccc1[N+](=O)[O-] ZINC000575823719 335119543 /nfs/dbraw/zinc/11/95/43/335119543.db2.gz ORYTVWDNHNWNFD-UHFFFAOYSA-N 0 0 290.363 4.036 20 5 CIBDRN Cc1cccc(N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1F ZINC000312297740 333079736 /nfs/dbraw/zinc/07/97/36/333079736.db2.gz SURJOELVSMCGJJ-NSHDSACASA-N 0 0 274.295 4.215 20 5 CIBDRN Cc1ccc([N+](=O)[O-])c(NCc2cccc3cccnc32)c1 ZINC000336854984 335121557 /nfs/dbraw/zinc/12/15/57/335121557.db2.gz SVZOKTVTQDKFPL-UHFFFAOYSA-N 0 0 293.326 4.064 20 5 CIBDRN CSc1cccc(C)c1NCc1cccc([N+](=O)[O-])c1 ZINC000185439696 333140751 /nfs/dbraw/zinc/14/07/51/333140751.db2.gz ATZDFVFBEGITLF-UHFFFAOYSA-N 0 0 288.372 4.237 20 5 CIBDRN CCCCCSc1ccc(C(C)=O)cc1[N+](=O)[O-] ZINC000223568017 333209401 /nfs/dbraw/zinc/20/94/01/333209401.db2.gz QSZQKSIWGZYPGL-UHFFFAOYSA-N 0 0 267.350 4.080 20 5 CIBDRN Cc1cc(C(=O)Nc2ccc(C(C)C)cc2)cc([N+](=O)[O-])c1 ZINC000195690262 333260882 /nfs/dbraw/zinc/26/08/82/333260882.db2.gz VZOILGZAWNCCKL-UHFFFAOYSA-N 0 0 298.342 4.279 20 5 CIBDRN C[C@H](Nc1ccccc1[N+](=O)[O-])c1cccc(F)c1F ZINC000231631811 333326328 /nfs/dbraw/zinc/32/63/28/333326328.db2.gz HFWQHBQZWNYXOR-VIFPVBQESA-N 0 0 278.258 4.046 20 5 CIBDRN Cc1ccc(CNc2cccc3cnccc32)cc1[N+](=O)[O-] ZINC000237807550 333381744 /nfs/dbraw/zinc/38/17/44/333381744.db2.gz HHDQIKPZGBCRNN-UHFFFAOYSA-N 0 0 293.326 4.064 20 5 CIBDRN CC(C)(C)c1csc(-c2ccccc2[N+](=O)[O-])n1 ZINC000125235427 333565181 /nfs/dbraw/zinc/56/51/81/333565181.db2.gz SPRIGAZNYLOGIN-UHFFFAOYSA-N 0 0 262.334 4.016 20 5 CIBDRN O=[N+]([O-])c1cc(CNc2cc(F)cc(Cl)c2)cs1 ZINC000128517591 333680979 /nfs/dbraw/zinc/68/09/79/333680979.db2.gz BCSVINMQTYBQKU-UHFFFAOYSA-N 0 0 286.715 4.061 20 5 CIBDRN CC(C)c1ccc(OCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000070268532 333805509 /nfs/dbraw/zinc/80/55/09/333805509.db2.gz KAWSLDHLLMWJJM-UHFFFAOYSA-N 0 0 271.316 4.297 20 5 CIBDRN Cc1cc(/C=C\c2ccc([N+](=O)[O-])cn2)cc2cccnc12 ZINC000544045207 333912403 /nfs/dbraw/zinc/91/24/03/333912403.db2.gz GDSBVWXDFFSFTC-PLNGDYQASA-N 0 0 291.310 4.017 20 5 CIBDRN Cc1cc([N+](=O)[O-])ccc1CNc1ccc(Cl)cc1 ZINC000544607530 333939808 /nfs/dbraw/zinc/93/98/08/333939808.db2.gz BAEVBAVCEPOPOD-UHFFFAOYSA-N 0 0 276.723 4.169 20 5 CIBDRN C[C@H](Nc1ccc([N+](=O)[O-])nc1)c1cc2ccccc2s1 ZINC000576189872 335167183 /nfs/dbraw/zinc/16/71/83/335167183.db2.gz WMNUKIGWLVWULE-JTQLQIEISA-N 0 0 299.355 4.378 20 5 CIBDRN Cc1ccc(-c2noc(/C=C\C(C)(C)C)n2)cc1[N+](=O)[O-] ZINC000544950373 333954589 /nfs/dbraw/zinc/95/45/89/333954589.db2.gz DQDFXVAMPVQMAD-FPLPWBNLSA-N 0 0 287.319 4.013 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1-c1nc([C@@H](C)C(C)(C)C)no1 ZINC000547128037 334068133 /nfs/dbraw/zinc/06/81/33/334068133.db2.gz ZNRJKOPIPUBAJZ-SNVBAGLBSA-N 0 0 289.335 4.103 20 5 CIBDRN C/C(=C\c1nc([C@@H](C)C2CC2)no1)c1ccc([N+](=O)[O-])cc1 ZINC000547213925 334073348 /nfs/dbraw/zinc/07/33/48/334073348.db2.gz RXSRPXJSRMNYBP-USKTWTLRSA-N 0 0 299.330 4.052 20 5 CIBDRN Cc1cscc1N[C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000576221690 335172685 /nfs/dbraw/zinc/17/26/85/335172685.db2.gz FZSBBSCXQLNDJP-CQSZACIVSA-N 0 0 288.372 4.454 20 5 CIBDRN Cc1ccc(C[C@H](C)Nc2ccc(F)cc2[N+](=O)[O-])s1 ZINC000134888332 334106976 /nfs/dbraw/zinc/10/69/76/334106976.db2.gz OSXYZJVXPDSOGV-VIFPVBQESA-N 0 0 294.351 4.147 20 5 CIBDRN CCc1ccc(Cn2ccc3c2cccc3[N+](=O)[O-])cc1 ZINC000135121090 334116463 /nfs/dbraw/zinc/11/64/63/334116463.db2.gz OZERPPDSFATWCY-UHFFFAOYSA-N 0 0 280.327 4.160 20 5 CIBDRN CC[C@H](CC(F)(F)F)Nc1c(C)cccc1[N+](=O)[O-] ZINC000547961143 334131687 /nfs/dbraw/zinc/13/16/87/334131687.db2.gz OOMPVTROKSMLNX-SECBINFHSA-N 0 0 276.258 4.046 20 5 CIBDRN Cc1cccc(NCc2ccc3ccccc3n2)c1[N+](=O)[O-] ZINC000549129661 334185735 /nfs/dbraw/zinc/18/57/35/334185735.db2.gz VOADHDYEOCIDGO-UHFFFAOYSA-N 0 0 293.326 4.064 20 5 CIBDRN CC(C)(C)c1cccc(Oc2ccc([N+](=O)[O-])nc2)c1 ZINC000550313204 334219818 /nfs/dbraw/zinc/21/98/18/334219818.db2.gz MNAQDKBFBWZZSI-UHFFFAOYSA-N 0 0 272.304 4.080 20 5 CIBDRN COc1cccc(CSc2c(F)cccc2[N+](=O)[O-])c1 ZINC000553328972 334377964 /nfs/dbraw/zinc/37/79/64/334377964.db2.gz PPONCLLKSRVODV-UHFFFAOYSA-N 0 0 293.319 4.035 20 5 CIBDRN CSc1cccc(F)c1CNc1ccccc1[N+](=O)[O-] ZINC000553580070 334392511 /nfs/dbraw/zinc/39/25/11/334392511.db2.gz GZTSKGGEYBQFIS-UHFFFAOYSA-N 0 0 292.335 4.068 20 5 CIBDRN C/C=C/c1ccc(NC(=O)c2cccc(C)c2[N+](=O)[O-])cc1 ZINC000553667413 334395096 /nfs/dbraw/zinc/39/50/96/334395096.db2.gz VBQDROPQHSNQGR-HWKANZROSA-N 0 0 296.326 4.189 20 5 CIBDRN CCCN(C(=O)CC[C@@H](C)CC)c1cccc([N+](=O)[O-])c1 ZINC000567958524 334779103 /nfs/dbraw/zinc/77/91/03/334779103.db2.gz OJQLANNUKGLMCF-ZDUSSCGKSA-N 0 0 292.379 4.164 20 5 CIBDRN Cc1ccc(CNc2nccc3sccc32)cc1[N+](=O)[O-] ZINC000158942960 334816833 /nfs/dbraw/zinc/81/68/33/334816833.db2.gz MPEGGNLUFYWBOR-UHFFFAOYSA-N 0 0 299.355 4.125 20 5 CIBDRN C[C@@H](Nc1cccc2ccncc21)c1cccc([N+](=O)[O-])c1 ZINC000316246655 334818799 /nfs/dbraw/zinc/81/87/99/334818799.db2.gz FFNHTQHWKGRQKI-GFCCVEGCSA-N 0 0 293.326 4.316 20 5 CIBDRN C[C@H](CC(C)(C)C)c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000569288262 334865420 /nfs/dbraw/zinc/86/54/20/334865420.db2.gz AHXHGJZANZZUSN-SNVBAGLBSA-N 0 0 289.335 4.185 20 5 CIBDRN CCCC(=O)COc1ccc(-c2ccccc2)cc1[N+](=O)[O-] ZINC000576505703 335212424 /nfs/dbraw/zinc/21/24/24/335212424.db2.gz HSOVYLRHSIYLLS-UHFFFAOYSA-N 0 0 299.326 4.010 20 5 CIBDRN Cc1c([C@H](C)Nc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000182664951 335835287 /nfs/dbraw/zinc/83/52/87/335835287.db2.gz YCFVWQORUJUGLH-NSHDSACASA-N 0 0 274.295 4.215 20 5 CIBDRN Cc1ccc(CNc2ccsc2Cl)cc1[N+](=O)[O-] ZINC000387166581 336186747 /nfs/dbraw/zinc/18/67/47/336186747.db2.gz AGSRLTCNLQMRMR-UHFFFAOYSA-N 0 0 282.752 4.230 20 5 CIBDRN C[C@H](Nc1cc(C2CC2)ccn1)c1ccc([N+](=O)[O-])cc1 ZINC000353621053 534015172 /nfs/dbraw/zinc/01/51/72/534015172.db2.gz KNSDIBANGQQOED-NSHDSACASA-N 0 0 283.331 4.040 20 5 CIBDRN CSc1cc(C)ccc1CNc1sccc1[N+](=O)[O-] ZINC000302033153 534146695 /nfs/dbraw/zinc/14/66/95/534146695.db2.gz SVESWXZDGXNTQQ-UHFFFAOYSA-N 0 0 294.401 4.299 20 5 CIBDRN Cc1ccc([N+](=O)[O-])c(C)c1NCCCCOC(C)(C)C ZINC000352547560 534325556 /nfs/dbraw/zinc/32/55/56/534325556.db2.gz IFOYSGAFEVMNFU-UHFFFAOYSA-N 0 0 294.395 4.219 20 5 CIBDRN Cc1ccnc(N[C@@H](C)c2cc3ccccc3o2)c1[N+](=O)[O-] ZINC000301280475 534403322 /nfs/dbraw/zinc/40/33/22/534403322.db2.gz JYJUQIIGUCNJDA-NSHDSACASA-N 0 0 297.314 4.218 20 5 CIBDRN C[C@H](NCc1cc([N+](=O)[O-])ccc1Cl)c1ccsc1 ZINC000061361189 525432801 /nfs/dbraw/zinc/43/28/01/525432801.db2.gz VIUBLPBSHKPYOF-VIFPVBQESA-N 0 0 296.779 4.161 20 5 CIBDRN Cc1cc([C@H](C)Nc2ccc([N+](=O)[O-])c(C)c2)c(C)o1 ZINC000044427982 525533661 /nfs/dbraw/zinc/53/36/61/525533661.db2.gz HMEPFTDMVDHFBQ-NSHDSACASA-N 0 0 274.320 4.286 20 5 CIBDRN O=[N+]([O-])c1c(F)cccc1NCc1ccc(C(F)F)cc1 ZINC000302148970 534879062 /nfs/dbraw/zinc/87/90/62/534879062.db2.gz APQMZXIPCBQUQG-UHFFFAOYSA-N 0 0 296.248 4.284 20 5 CIBDRN O=[N+]([O-])c1ccc(Sc2ccccc2)c2ncccc12 ZINC000301068327 534883122 /nfs/dbraw/zinc/88/31/22/534883122.db2.gz HNEXQWNUJIIIGI-UHFFFAOYSA-N 0 0 282.324 4.294 20 5 CIBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)CC1(C)CCCC1 ZINC000340939911 526055541 /nfs/dbraw/zinc/05/55/41/526055541.db2.gz NXFRIZHQQZWFHH-UHFFFAOYSA-N 0 0 290.363 4.121 20 5 CIBDRN O=[N+]([O-])c1ccccc1N[C@H](c1ccccc1)C1CC1 ZINC000041064178 527404595 /nfs/dbraw/zinc/40/45/95/527404595.db2.gz UZTAAWLPVHVLFK-MRXNPFEDSA-N 0 0 268.316 4.158 20 5 CIBDRN CC(C)C[C@@H](Nc1ccc([N+](=O)[O-])cn1)c1cccs1 ZINC000301550637 528361262 /nfs/dbraw/zinc/36/12/62/528361262.db2.gz MBJYIAGAFSJOLB-GFCCVEGCSA-N 0 0 291.376 4.251 20 5 CIBDRN CC(C)C[C@H]1CCN(c2ccc([N+](=O)[O-])c3cnccc32)C1 ZINC000301416889 528597087 /nfs/dbraw/zinc/59/70/87/528597087.db2.gz FTYNZUWMGRVOHI-CYBMUJFWSA-N 0 0 299.374 4.015 20 5 CIBDRN CCOc1ccc([C@@H](C)Nc2sccc2[N+](=O)[O-])cc1 ZINC000301974827 528597909 /nfs/dbraw/zinc/59/79/09/528597909.db2.gz BFCWXIYBIYCVBM-SNVBAGLBSA-N 0 0 292.360 4.228 20 5 CIBDRN Cc1ccc([C@@H](C)Nc2ccc(F)cc2[N+](=O)[O-])s1 ZINC000036967059 260058772 /nfs/dbraw/zinc/05/87/72/260058772.db2.gz NXLAWCATEADXJY-SECBINFHSA-N 0 0 280.324 4.277 20 5 CIBDRN CCCC[C@H](CC)C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000005467493 170102103 /nfs/dbraw/zinc/10/21/03/170102103.db2.gz YQQANPMIQQNUCM-LBPRGKRZSA-N 0 0 278.352 4.058 20 5 CIBDRN O=C(Nc1ccc([N+](=O)[O-])cc1)c1ccc2ccccc2c1 ZINC000005669933 170126080 /nfs/dbraw/zinc/12/60/80/170126080.db2.gz NLUWLSIWLAKEAN-UHFFFAOYSA-N 0 0 292.294 4.000 20 5 CIBDRN O=C(Nc1cccc([N+](=O)[O-])c1)c1ccc2ccccc2c1 ZINC000005704489 170131327 /nfs/dbraw/zinc/13/13/27/170131327.db2.gz RYVPBMJIUCQSLK-UHFFFAOYSA-N 0 0 292.294 4.000 20 5 CIBDRN COc1ccc(Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000006897200 170253955 /nfs/dbraw/zinc/25/39/55/170253955.db2.gz PXUPUCCGHRJUBB-UHFFFAOYSA-N 0 0 278.695 4.000 20 5 CIBDRN CCCCNc1nc(-c2ccc(C)c([N+](=O)[O-])c2)cs1 ZINC000007889387 170306281 /nfs/dbraw/zinc/30/62/81/170306281.db2.gz IVTORRAQKOWNHS-UHFFFAOYSA-N 0 0 291.376 4.239 20 5 CIBDRN CC(=O)c1ccc(Oc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000008079694 170318194 /nfs/dbraw/zinc/31/81/94/170318194.db2.gz OCUDXJHRURWOCT-UHFFFAOYSA-N 0 0 291.690 4.243 20 5 CIBDRN O=[N+]([O-])c1cccc(-c2csc(-c3ccsc3)n2)c1 ZINC000008102529 170318817 /nfs/dbraw/zinc/31/88/17/170318817.db2.gz CNJHYHRTHOHSTO-UHFFFAOYSA-N 0 0 288.353 4.447 20 5 CIBDRN CCC[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000008286456 170328917 /nfs/dbraw/zinc/32/89/17/170328917.db2.gz GRNOLUYJYAOHQR-INIZCTEOSA-N 0 0 298.342 4.117 20 5 CIBDRN CC(C)c1ccccc1NCc1ccccc1[N+](=O)[O-] ZINC000020044492 170977196 /nfs/dbraw/zinc/97/71/96/170977196.db2.gz NNOQWOALUPXOCW-UHFFFAOYSA-N 0 0 270.332 4.330 20 5 CIBDRN Cc1cccc(N[C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000020525891 171238926 /nfs/dbraw/zinc/23/89/26/171238926.db2.gz DVVVCLWPFSBABS-LBPRGKRZSA-N 0 0 256.305 4.076 20 5 CIBDRN Cc1ccc(N[C@@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000020526117 171239076 /nfs/dbraw/zinc/23/90/76/171239076.db2.gz RVJLOESRTNJCPE-LBPRGKRZSA-N 0 0 256.305 4.076 20 5 CIBDRN CCCC(CCC)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000021124924 171298200 /nfs/dbraw/zinc/29/82/00/171298200.db2.gz HYTGIAYWYVJYKZ-UHFFFAOYSA-N 0 0 278.352 4.058 20 5 CIBDRN CCn1c(SC(C)C)nc2cc3ccccc3cc2c1=O ZINC000022177714 171371248 /nfs/dbraw/zinc/37/12/48/171371248.db2.gz MWDWDVPGJLCRIC-UHFFFAOYSA-N 0 0 298.411 4.070 20 5 CIBDRN C[C@H](CCc1ccccc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000034979439 171912056 /nfs/dbraw/zinc/91/20/56/171912056.db2.gz KSERUIVHPIKRMW-CYBMUJFWSA-N 0 0 270.332 4.028 20 5 CIBDRN Cc1ccccc1NCc1cc([N+](=O)[O-])ccc1Cl ZINC000035368159 172159694 /nfs/dbraw/zinc/15/96/94/172159694.db2.gz MAVIAADTMJEZRS-UHFFFAOYSA-N 0 0 276.723 4.169 20 5 CIBDRN Cc1c(CNc2cc(Cl)ccc2F)cccc1[N+](=O)[O-] ZINC000035648920 172325260 /nfs/dbraw/zinc/32/52/60/172325260.db2.gz PVVYFQDXIZGUSL-UHFFFAOYSA-N 0 0 294.713 4.308 20 5 CIBDRN Cc1cccc(N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000037176732 173010411 /nfs/dbraw/zinc/01/04/11/173010411.db2.gz RSUYJRJJBXCLBK-LBPRGKRZSA-N 0 0 256.305 4.076 20 5 CIBDRN O=[N+]([O-])c1ccc(Cl)c(CSc2ccc(O)cc2)c1 ZINC000038079307 174089292 /nfs/dbraw/zinc/08/92/92/174089292.db2.gz JGIHBQNXCXSKAK-UHFFFAOYSA-N 0 0 295.747 4.246 20 5 CIBDRN Cc1cccc([N+](=O)[O-])c1N1CCC[C@H]1c1cccs1 ZINC000301181145 227469416 /nfs/dbraw/zinc/46/94/16/227469416.db2.gz PTAYWIRAIWIWMB-LBPRGKRZSA-N 0 0 288.372 4.306 20 5 CIBDRN O=[N+]([O-])c1cc(Cl)ccc1Oc1cccc(F)c1F ZINC000302777439 227886256 /nfs/dbraw/zinc/88/62/56/227886256.db2.gz PKPGSFVHADTGKX-UHFFFAOYSA-N 0 0 285.633 4.319 20 5 CIBDRN CCc1c[nH]c(S[C@@H](C)c2cc([N+](=O)[O-])ccc2C)n1 ZINC000180082405 260092320 /nfs/dbraw/zinc/09/23/20/260092320.db2.gz FGBOHFBUHBHVGO-JTQLQIEISA-N 0 0 291.376 4.042 20 5 CIBDRN CC[C@H](Nc1ccc(Cl)cc1[N+](=O)[O-])c1nccs1 ZINC000078004764 260167896 /nfs/dbraw/zinc/16/78/96/260167896.db2.gz DMBBKYDHWDQXSM-VIFPVBQESA-N 0 0 297.767 4.268 20 5 CIBDRN Cc1cccc(Cl)c1NCc1ccccc1[N+](=O)[O-] ZINC000090496840 260260117 /nfs/dbraw/zinc/26/01/17/260260117.db2.gz GFKSPLNHADAJPK-UHFFFAOYSA-N 0 0 276.723 4.169 20 5 CIBDRN CCc1ccc([C@H](C)Nc2ncc(C)cc2[N+](=O)[O-])cc1 ZINC000090692068 260382463 /nfs/dbraw/zinc/38/24/63/260382463.db2.gz NCMKRGFRRQNVGS-LBPRGKRZSA-N 0 0 285.347 4.034 20 5 CIBDRN Cc1c2ccsc2nc(-c2cccc([N+](=O)[O-])c2)c1C ZINC000427455744 260741567 /nfs/dbraw/zinc/74/15/67/260741567.db2.gz LOJRHHHDTFLVDI-UHFFFAOYSA-N 0 0 284.340 4.488 20 5 CIBDRN Cc1cc(-c2cccc([N+](=O)[O-])c2)nc2sccc21 ZINC000427470073 260744763 /nfs/dbraw/zinc/74/47/63/260744763.db2.gz FHMILUHUWZGKNQ-UHFFFAOYSA-N 0 0 270.313 4.180 20 5 CIBDRN Cc1nc(CSCc2cccc([N+](=O)[O-])c2C)cs1 ZINC000105637141 261314178 /nfs/dbraw/zinc/31/41/78/261314178.db2.gz MYXMXMHHEQLSTD-UHFFFAOYSA-N 0 0 294.401 4.102 20 5 CIBDRN Cc1ccc(NCc2cccc3cccnc32)c([N+](=O)[O-])c1 ZINC000301121495 261329928 /nfs/dbraw/zinc/32/99/28/261329928.db2.gz ZLSIKHVJCCFQPV-UHFFFAOYSA-N 0 0 293.326 4.064 20 5 CIBDRN Cc1cccc(CNc2ccc3cc([N+](=O)[O-])ccc3n2)c1 ZINC000301081024 261330116 /nfs/dbraw/zinc/33/01/16/261330116.db2.gz ILKGNHJIZGFECQ-UHFFFAOYSA-N 0 0 293.326 4.064 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)SC1=N[C@@H](C)CS1 ZINC000180115024 261840861 /nfs/dbraw/zinc/84/08/61/261840861.db2.gz BPHHJKWIWDTQFR-UWVGGRQHSA-N 0 0 296.417 4.189 20 5 CIBDRN CC[C@@H]1CCCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000522693127 261883730 /nfs/dbraw/zinc/88/37/30/261883730.db2.gz JOBWWWWFQUCSMG-CYBMUJFWSA-N 0 0 299.374 4.160 20 5 CIBDRN Cc1ccc([C@H](C)Nc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000021027096 262374201 /nfs/dbraw/zinc/37/42/01/262374201.db2.gz MLPULUZSAOCEDG-NSHDSACASA-N 0 0 274.295 4.215 20 5 CIBDRN O=[N+]([O-])c1ccc(NCc2ccc(C3CC3)cc2)cc1 ZINC000094518738 262452923 /nfs/dbraw/zinc/45/29/23/262452923.db2.gz VRNRWUAVYSTHEI-UHFFFAOYSA-N 0 0 268.316 4.084 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)C1CCC(C)(C)CC1 ZINC000426022058 264394110 /nfs/dbraw/zinc/39/41/10/264394110.db2.gz MWMRPWOBHXEATK-UHFFFAOYSA-N 0 0 290.363 4.058 20 5 CIBDRN O=[N+]([O-])c1ccccc1COc1cc(Cl)ccc1Cl ZINC000096463074 265366399 /nfs/dbraw/zinc/36/63/99/265366399.db2.gz KESBDKQJLBGNKO-UHFFFAOYSA-N 0 0 298.125 4.481 20 5 CIBDRN C[C@H]1CCC[C@@H](c2noc(-c3ccc([N+](=O)[O-])s3)n2)C1 ZINC000356222483 266074903 /nfs/dbraw/zinc/07/49/03/266074903.db2.gz PRCJSWSLBJRDLR-DTWKUNHWSA-N 0 0 293.348 4.000 20 5 CIBDRN Cc1cc(C)c(NC(=O)c2ccc([N+](=O)[O-])cc2C)c(C)c1 ZINC000357283592 266272168 /nfs/dbraw/zinc/27/21/68/266272168.db2.gz NAVSOOPGGBQKJG-UHFFFAOYSA-N 0 0 298.342 4.081 20 5 CIBDRN Cc1cccc([N+](=O)[O-])c1NCc1ccc2ncccc2c1 ZINC000357677752 266344757 /nfs/dbraw/zinc/34/47/57/266344757.db2.gz ALSYYBFVQNQWES-UHFFFAOYSA-N 0 0 293.326 4.064 20 5 CIBDRN Cc1occc1S[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000358806546 266494857 /nfs/dbraw/zinc/49/48/57/266494857.db2.gz 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ZINC000387552724 327321218 /nfs/dbraw/zinc/32/12/18/327321218.db2.gz CLKZPWZRVBUJPG-UHFFFAOYSA-N 0 0 293.326 4.064 20 5 CIBDRN O=[N+]([O-])c1ccccc1N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000561357452 327388934 /nfs/dbraw/zinc/38/89/34/327388934.db2.gz BVBAFBTZTVGDIE-CYBMUJFWSA-N 0 0 288.734 4.200 20 5 CIBDRN CCc1nocc1CS[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000570696792 327611882 /nfs/dbraw/zinc/61/18/82/327611882.db2.gz UPSUZAGWACUCDB-JTQLQIEISA-N 0 0 292.360 4.140 20 5 CIBDRN CC1CCC(N(C)c2ccc([N+](=O)[O-])c3cnccc32)CC1 ZINC000104861318 328810488 /nfs/dbraw/zinc/81/04/88/328810488.db2.gz WILJLCKBAQIHBE-UHFFFAOYSA-N 0 0 299.374 4.158 20 5 CIBDRN CC[C@H](C)c1csc(-c2ccccc2[N+](=O)[O-])n1 ZINC000134962825 328811393 /nfs/dbraw/zinc/81/13/93/328811393.db2.gz VDARTHLCSHUBOS-VIFPVBQESA-N 0 0 262.334 4.232 20 5 CIBDRN O=[N+]([O-])c1cccc2c1ccn2CCCCC(F)(F)F ZINC000507871605 332828541 /nfs/dbraw/zinc/82/85/41/332828541.db2.gz XGNCWLYCNGRQIR-UHFFFAOYSA-N 0 0 286.253 4.282 20 5 CIBDRN O=[N+]([O-])c1ccc(NC2CCC(F)(F)CC2)c(Cl)c1 ZINC000389952690 328963286 /nfs/dbraw/zinc/96/32/86/328963286.db2.gz NTSXNFKKSMAYAV-UHFFFAOYSA-N 0 0 290.697 4.238 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)SCc1nccs1 ZINC000180715573 329222413 /nfs/dbraw/zinc/22/24/13/329222413.db2.gz UUQKNRWOQRJWSC-JTQLQIEISA-N 0 0 294.401 4.354 20 5 CIBDRN Cc1c(NC(=O)C[C@H]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000508776231 332850131 /nfs/dbraw/zinc/85/01/31/332850131.db2.gz ZZGZNAIKLSTTIC-YPMHNXCESA-N 0 0 290.363 4.058 20 5 CIBDRN O=[N+]([O-])c1cccc(SCc2cc(F)ccc2F)c1 ZINC000509088868 332858700 /nfs/dbraw/zinc/85/87/00/332858700.db2.gz GTSWHLJMSPDCOE-UHFFFAOYSA-N 0 0 281.283 4.165 20 5 CIBDRN C[C@@H](Nc1ccc([N+](=O)[O-])cn1)c1ccc(C2CC2)cc1 ZINC000419010650 329705622 /nfs/dbraw/zinc/70/56/22/329705622.db2.gz YHWWXXCOMGQISD-LLVKDONJSA-N 0 0 283.331 4.040 20 5 CIBDRN C[C@H](SCCC1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000419477011 329735730 /nfs/dbraw/zinc/73/57/30/329735730.db2.gz HELAYLNDXPTLMY-LBPRGKRZSA-N 0 0 295.404 4.206 20 5 CIBDRN CC(C)c1nc(CSc2cccc([N+](=O)[O-])c2)cs1 ZINC000509709456 332880042 /nfs/dbraw/zinc/88/00/42/332880042.db2.gz WOIAMZVZJUJLPA-UHFFFAOYSA-N 0 0 294.401 4.467 20 5 CIBDRN Cc1ncc(CSCc2cccc([N+](=O)[O-])c2C)s1 ZINC000068977001 329853540 /nfs/dbraw/zinc/85/35/40/329853540.db2.gz LFALHDHCMQVNFD-UHFFFAOYSA-N 0 0 294.401 4.102 20 5 CIBDRN Cc1c([C@@H](C)Nc2ccc3c(c2)CCN3)cccc1[N+](=O)[O-] ZINC000423221123 330179515 /nfs/dbraw/zinc/17/95/15/330179515.db2.gz WGZLGRKGXIEWAV-GFCCVEGCSA-N 0 0 297.358 4.044 20 5 CIBDRN CC[C@H](Nc1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000036721093 330257988 /nfs/dbraw/zinc/25/79/88/330257988.db2.gz WYFDOQCTARKXHJ-HNNXBMFYSA-N 0 0 292.285 4.436 20 5 CIBDRN O=[N+]([O-])c1ccccc1Sc1c(F)cc(F)cc1F ZINC000515592214 330480119 /nfs/dbraw/zinc/48/01/19/330480119.db2.gz OASYYCGUGJLFRB-UHFFFAOYSA-N 0 0 285.246 4.163 20 5 CIBDRN Cc1ccc(/C=C/c2ccc([N+](=O)[O-])cn2)cc1Cl ZINC000435753793 330662254 /nfs/dbraw/zinc/66/22/54/330662254.db2.gz SVXBPQJSBDKFJL-SNAWJCMRSA-N 0 0 274.707 4.122 20 5 CIBDRN O=[N+]([O-])c1cccc2ccc(/C=C\c3ccc(O)cc3)nc21 ZINC000436806269 330685537 /nfs/dbraw/zinc/68/55/37/330685537.db2.gz ICNMDPRRAIFNHQ-YWEYNIOJSA-N 0 0 292.294 4.019 20 5 CIBDRN C[C@@H](SCC1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000437452631 330700041 /nfs/dbraw/zinc/70/00/41/330700041.db2.gz UTHAUHIGAOMHEO-SNVBAGLBSA-N 0 0 251.351 4.189 20 5 CIBDRN O=[N+]([O-])c1cccc(F)c1OCc1cc(F)ccc1Cl ZINC000438297264 330720919 /nfs/dbraw/zinc/72/09/19/330720919.db2.gz HAKXFAMCOAKOFU-UHFFFAOYSA-N 0 0 299.660 4.105 20 5 CIBDRN Cc1cc2cc(C(=O)c3ccc([N+](=O)[O-])cc3)oc2cc1C ZINC000438820608 330729427 /nfs/dbraw/zinc/72/94/27/330729427.db2.gz AQABKQQDRCNTHM-UHFFFAOYSA-N 0 0 295.294 4.189 20 5 CIBDRN O=[N+]([O-])c1cccc(F)c1OCc1ccc(Cl)c(F)c1 ZINC000442909704 330791484 /nfs/dbraw/zinc/79/14/84/330791484.db2.gz TYTQTKSAORHOLD-UHFFFAOYSA-N 0 0 299.660 4.105 20 5 CIBDRN CC(C)(C)c1cccc(Oc2ncc([N+](=O)[O-])s2)c1 ZINC000443405638 330798944 /nfs/dbraw/zinc/79/89/44/330798944.db2.gz BQBQGUSPYZRDPQ-UHFFFAOYSA-N 0 0 278.333 4.141 20 5 CIBDRN CC(C)[C@H]1CCCN(c2ccc([N+](=O)[O-])c3cnccc32)C1 ZINC000443988591 330808626 /nfs/dbraw/zinc/80/86/26/330808626.db2.gz LSPLSAVTSYUFJK-ZDUSSCGKSA-N 0 0 299.374 4.015 20 5 CIBDRN Cc1cc(N[C@H](CC(F)(F)F)C(C)C)ccc1[N+](=O)[O-] ZINC000445660167 330834034 /nfs/dbraw/zinc/83/40/34/330834034.db2.gz MSOXLVSXEOUFLL-LLVKDONJSA-N 0 0 290.285 4.292 20 5 CIBDRN C[C@@H](CCCC(F)(F)F)Nc1ccc(F)cc1[N+](=O)[O-] ZINC000163274920 331013972 /nfs/dbraw/zinc/01/39/72/331013972.db2.gz UIXIYXABRBFOAW-QMMMGPOBSA-N 0 0 294.248 4.267 20 5 CIBDRN Cc1cc(N[C@@H](C)CCCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000163397801 331032381 /nfs/dbraw/zinc/03/23/81/331032381.db2.gz GGHQSNBDQKVZEY-JTQLQIEISA-N 0 0 290.285 4.436 20 5 CIBDRN O=[N+]([O-])c1ccc(Nc2ccc3[nH]ccc3c2)c(Cl)c1 ZINC000510655827 332909613 /nfs/dbraw/zinc/90/96/13/332909613.db2.gz CAQDXLBEOHXLTH-UHFFFAOYSA-N 0 0 287.706 4.473 20 5 CIBDRN CCC[C@H](Nc1ccc(C)nc1)c1cccc([N+](=O)[O-])c1 ZINC000164550070 331251898 /nfs/dbraw/zinc/25/18/98/331251898.db2.gz GOQKKGPRLFVSRR-INIZCTEOSA-N 0 0 285.347 4.252 20 5 CIBDRN Cc1cc(Oc2c(F)cccc2F)c(F)cc1[N+](=O)[O-] ZINC000461738869 331314253 /nfs/dbraw/zinc/31/42/53/331314253.db2.gz OTHKPZDDLHSYDX-UHFFFAOYSA-N 0 0 283.205 4.113 20 5 CIBDRN CC[C@@H](CC(F)(F)F)Nc1cc(C)c([N+](=O)[O-])cc1F ZINC000461940003 331315853 /nfs/dbraw/zinc/31/58/53/331315853.db2.gz ZPYLQSRUEWYMPM-QMMMGPOBSA-N 0 0 294.248 4.185 20 5 CIBDRN CCC[C@H](CCc1ccccc1)Nc1ccc([N+](=O)[O-])cn1 ZINC000462876648 331333622 /nfs/dbraw/zinc/33/36/22/331333622.db2.gz XKKFLSFNDKLQTB-OAHLLOKOSA-N 0 0 299.374 4.203 20 5 CIBDRN CC1(C)CCCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000462889611 331334037 /nfs/dbraw/zinc/33/40/37/331334037.db2.gz UHRNQEPHNFFUQB-UHFFFAOYSA-N 0 0 299.374 4.160 20 5 CIBDRN C[C@@H](CNc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000463028397 331337512 /nfs/dbraw/zinc/33/75/12/331337512.db2.gz KRSNAZMHSOXVCK-JTQLQIEISA-N 0 0 292.285 4.089 20 5 CIBDRN Cc1ncsc1/C=C\c1ccc2c(cccc2[N+](=O)[O-])n1 ZINC000463047908 331338641 /nfs/dbraw/zinc/33/86/41/331338641.db2.gz JHQMARORMLOUBJ-VURMDHGXSA-N 0 0 297.339 4.078 20 5 CIBDRN Cc1cnc(Sc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000463052066 331338778 /nfs/dbraw/zinc/33/87/78/331338778.db2.gz KLHZXXDCCSGMKA-UHFFFAOYSA-N 0 0 280.736 4.103 20 5 CIBDRN CC[C@H](Nc1ncc(C)cc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000463057656 331338973 /nfs/dbraw/zinc/33/89/73/331338973.db2.gz RSYSJOLFBFVSDY-AWEZNQCLSA-N 0 0 285.347 4.170 20 5 CIBDRN Cc1cnc(N[C@@H](c2ccccc2C)C(C)C)c([N+](=O)[O-])c1 ZINC000463059139 331339069 /nfs/dbraw/zinc/33/90/69/331339069.db2.gz XIDUBBJEJJGZCG-MRXNPFEDSA-N 0 0 299.374 4.416 20 5 CIBDRN CCC[C@@H](Nc1ncc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000463059055 331339093 /nfs/dbraw/zinc/33/90/93/331339093.db2.gz ZCCIOZZOPWVGSS-CQSZACIVSA-N 0 0 285.347 4.252 20 5 CIBDRN Cc1cnc(N[C@H](c2ccccc2C)C2CC2)c([N+](=O)[O-])c1 ZINC000463060627 331339111 /nfs/dbraw/zinc/33/91/11/331339111.db2.gz 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/nfs/dbraw/zinc/47/32/82/334473282.db2.gz SZKGFPIVRTXPKL-UHFFFAOYSA-N 0 0 280.736 4.103 20 5 CIBDRN Cc1ccc(N[C@@H]2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000565214356 334545370 /nfs/dbraw/zinc/54/53/70/334545370.db2.gz FTFDJSZDUYBFPB-OAHLLOKOSA-N 0 0 268.316 4.003 20 5 CIBDRN Cc1cccc(OCc2ccccc2Cl)c1[N+](=O)[O-] ZINC000566877032 334667999 /nfs/dbraw/zinc/66/79/99/334667999.db2.gz ZMVQQLVIQUXFFF-UHFFFAOYSA-N 0 0 277.707 4.136 20 5 CIBDRN C/C=C\c1ccc(NCc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000577099411 335300144 /nfs/dbraw/zinc/30/01/44/335300144.db2.gz AHGQDIFDXASNJK-ARJAWSKDSA-N 0 0 298.342 4.249 20 5 CIBDRN CC(C)c1ccc(Sc2ccc([N+](=O)[O-])nc2)cc1 ZINC000578170800 335541087 /nfs/dbraw/zinc/54/10/87/335541087.db2.gz LZQKZZPLJRBWKX-UHFFFAOYSA-N 0 0 274.345 4.264 20 5 CIBDRN Cc1cscc1N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000387181412 336187354 /nfs/dbraw/zinc/18/73/54/336187354.db2.gz DNIOOIPYBDDNDN-JTQLQIEISA-N 0 0 262.334 4.138 20 5 CIBDRN O=[N+]([O-])c1cccc(SCCCCC(F)(F)F)c1 ZINC000509089804 518203187 /nfs/dbraw/zinc/20/31/87/518203187.db2.gz MCASKWAMFUUNEM-UHFFFAOYSA-N 0 0 279.283 4.420 20 5 CIBDRN Cc1sc(CNc2ccc([N+](=O)[O-])cc2)nc1C(C)C ZINC000347182753 534607393 /nfs/dbraw/zinc/60/73/93/534607393.db2.gz ALNPFNINJCWVMO-UHFFFAOYSA-N 0 0 291.376 4.095 20 5 CIBDRN CC[C@@H](Nc1cc(C)ccc1[N+](=O)[O-])c1c(C)noc1C ZINC000339785592 522953988 /nfs/dbraw/zinc/95/39/88/522953988.db2.gz BJZLFXAZZXUAEU-GFCCVEGCSA-N 0 0 289.335 4.071 20 5 CIBDRN Cc1cc(N[C@H](C)c2ccc(F)cc2F)ccc1[N+](=O)[O-] ZINC000042246496 525300729 /nfs/dbraw/zinc/30/07/29/525300729.db2.gz IJECVMKIPCSXAV-SNVBAGLBSA-N 0 0 292.285 4.355 20 5 CIBDRN Cc1ccc([C@H](C)NCc2cc([N+](=O)[O-])ccc2Cl)o1 ZINC000036960108 525928694 /nfs/dbraw/zinc/92/86/94/525928694.db2.gz IYNFOSYEAIYPOS-JTQLQIEISA-N 0 0 294.738 4.000 20 5 CIBDRN O=[N+]([O-])c1ccc(N[C@@H](c2ccccc2)C2CC2)cc1 ZINC000041064179 527366913 /nfs/dbraw/zinc/36/69/13/527366913.db2.gz DZSAPVSUUYXAPN-INIZCTEOSA-N 0 0 268.316 4.158 20 5 CIBDRN O=[N+]([O-])c1cccc(SCc2csc(C3CC3)n2)c1 ZINC000337904363 527393880 /nfs/dbraw/zinc/39/38/80/527393880.db2.gz ADPDTGLRKQYLJY-UHFFFAOYSA-N 0 0 292.385 4.221 20 5 CIBDRN O=[N+]([O-])c1ccc(/C=C/c2nc3ccccc3s2)cc1 ZINC000004069965 230368234 /nfs/dbraw/zinc/36/82/34/230368234.db2.gz CDPSBZCZTHXDSI-JXMROGBWSA-N 0 0 282.324 4.375 20 5 CIBDRN CC[C@H](Nc1ncc([N+](=O)[O-])s1)c1cccc(Cl)c1 ZINC000192471090 529681479 /nfs/dbraw/zinc/68/14/79/529681479.db2.gz ZMTUETLUXIDLKA-JTQLQIEISA-N 0 0 297.767 4.268 20 5 CIBDRN C/C=C/c1ccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000573550671 334946308 /nfs/dbraw/zinc/94/63/08/334946308.db2.gz BUYNBDNHRXIPCH-ONEGZZNKSA-N 0 0 296.326 4.189 20 5 CIBDRN Cc1ccc(Oc2c(Cl)cc([N+](=O)[O-])cc2Cl)cn1 ZINC000302046056 260210363 /nfs/dbraw/zinc/21/03/63/260210363.db2.gz UOPORIJLNHVZPQ-UHFFFAOYSA-N 0 0 299.113 4.397 20 5 CIBDRN C[C@@H](Nc1cc(C2CC2)ccn1)c1ccc([N+](=O)[O-])cc1 ZINC000353621050 533551270 /nfs/dbraw/zinc/55/12/70/533551270.db2.gz KNSDIBANGQQOED-LLVKDONJSA-N 0 0 283.331 4.040 20 5 CIBDRN O=[N+]([O-])c1ccc(CSCc2cccnc2)c(Cl)c1 ZINC000341996413 130188585 /nfs/dbraw/zinc/18/85/85/130188585.db2.gz APWFFGVJHLZNMQ-UHFFFAOYSA-N 0 0 294.763 4.077 20 5 CIBDRN CC(C)(C)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000005284322 170082857 /nfs/dbraw/zinc/08/28/57/170082857.db2.gz YQAAXBZHQFIBKA-UHFFFAOYSA-N 0 0 298.342 4.145 20 5 CIBDRN Nc1c(Cl)cc(Nc2ccccc2[N+](=O)[O-])cc1Cl ZINC000008198162 170324147 /nfs/dbraw/zinc/32/41/47/170324147.db2.gz BAMYBDNHAIFWNG-UHFFFAOYSA-N 0 0 298.129 4.227 20 5 CIBDRN O=[N+]([O-])c1cccc(CSc2ccc3ccccc3n2)c1 ZINC000010140037 170398708 /nfs/dbraw/zinc/39/87/08/170398708.db2.gz BGRNZLQGXILVKD-UHFFFAOYSA-N 0 0 296.351 4.435 20 5 CIBDRN CC(=O)c1ccc(SCc2ccccc2)c([N+](=O)[O-])c1 ZINC000019871697 170902236 /nfs/dbraw/zinc/90/22/36/170902236.db2.gz SOPSHOYTWZRUDS-UHFFFAOYSA-N 0 0 287.340 4.090 20 5 CIBDRN C[C@@H](Nc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000021812449 171329835 /nfs/dbraw/zinc/32/98/35/171329835.db2.gz UFUVFDGPPVJYIS-SNVBAGLBSA-N 0 0 276.723 4.421 20 5 CIBDRN CCCc1ccccc1NC(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000024502037 171436136 /nfs/dbraw/zinc/43/61/36/171436136.db2.gz GCGBECHUIRDUOH-UHFFFAOYSA-N 0 0 298.342 4.108 20 5 CIBDRN O=[N+]([O-])c1cccc(NCc2ccc(C(F)(F)F)cc2)c1 ZINC000035223776 172067797 /nfs/dbraw/zinc/06/77/97/172067797.db2.gz HTNIOTFICMJSSI-UHFFFAOYSA-N 0 0 296.248 4.226 20 5 CIBDRN Cc1cc(N[C@@H](C)Cc2cccs2)ccc1[N+](=O)[O-] ZINC000070141391 175873599 /nfs/dbraw/zinc/87/35/99/175873599.db2.gz CRFYCLKJZCNVTF-NSHDSACASA-N 0 0 276.361 4.008 20 5 CIBDRN Cc1ccc(Cl)c(OCc2ccc([N+](=O)[O-])cc2)c1 ZINC000072099811 176315302 /nfs/dbraw/zinc/31/53/02/176315302.db2.gz PVVFWHVUVJKEQD-UHFFFAOYSA-N 0 0 277.707 4.136 20 5 CIBDRN O=[N+]([O-])c1ccc(F)cc1OCc1ccc(F)cc1Cl ZINC000072099753 176315509 /nfs/dbraw/zinc/31/55/09/176315509.db2.gz JVKYGUVGRQWVTP-UHFFFAOYSA-N 0 0 299.660 4.105 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)Sc1ccccn1 ZINC000179979950 260084737 /nfs/dbraw/zinc/08/47/37/260084737.db2.gz GOOCJOXNMSKYLW-NSHDSACASA-N 0 0 274.345 4.152 20 5 CIBDRN Cc1cccc(C)c1NCc1c(F)cc([N+](=O)[O-])cc1F ZINC000349768270 226830384 /nfs/dbraw/zinc/83/03/84/226830384.db2.gz OQNYVUNSHCRRIM-UHFFFAOYSA-N 0 0 292.285 4.102 20 5 CIBDRN Cc1cc(N[C@@H]2CCCOc3ccccc32)ccc1[N+](=O)[O-] ZINC000301106673 227450292 /nfs/dbraw/zinc/45/02/92/227450292.db2.gz IVKHZRIOUZAIJW-OAHLLOKOSA-N 0 0 298.342 4.229 20 5 CIBDRN Cc1cnc(SCc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000302728092 227880434 /nfs/dbraw/zinc/88/04/34/227880434.db2.gz QFXGEGYGKNXOMN-UHFFFAOYSA-N 0 0 294.763 4.244 20 5 CIBDRN Cc1cc(NC(=O)c2cccc([N+](=O)[O-])c2)ccc1C1CC1 ZINC000355876490 228032071 /nfs/dbraw/zinc/03/20/71/228032071.db2.gz CVGCDWIEELWCFW-UHFFFAOYSA-N 0 0 296.326 4.033 20 5 CIBDRN C[C@@H](CC(C)(C)c1ccccc1)Nc1ncccc1[N+](=O)[O-] ZINC000521357744 260085314 /nfs/dbraw/zinc/08/53/14/260085314.db2.gz JCHAQDLRXFNYMB-ZDUSSCGKSA-N 0 0 299.374 4.158 20 5 CIBDRN Cc1cc(CNc2cc(F)cc([N+](=O)[O-])c2)c(C)s1 ZINC000229547060 260132654 /nfs/dbraw/zinc/13/26/54/260132654.db2.gz SUVXZOCKJGSYQU-UHFFFAOYSA-N 0 0 280.324 4.024 20 5 CIBDRN CCc1ccc(NCc2ccc([N+](=O)[O-])cc2)cc1C ZINC000312505020 260133628 /nfs/dbraw/zinc/13/36/28/260133628.db2.gz ALVRBZBAEFOOCI-UHFFFAOYSA-N 0 0 270.332 4.078 20 5 CIBDRN Cc1noc(C)c1[C@@H](C)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000072946956 260164776 /nfs/dbraw/zinc/16/47/76/260164776.db2.gz QOLJECUPAINZRS-SSDOTTSWSA-N 0 0 295.726 4.026 20 5 CIBDRN Cc1ccsc1CNc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000076652344 260166685 /nfs/dbraw/zinc/16/66/85/260166685.db2.gz BWHZQOMZRHVUJW-UHFFFAOYSA-N 0 0 299.355 4.125 20 5 CIBDRN CC[C@@H](Nc1ccc(Cl)cc1[N+](=O)[O-])c1nccs1 ZINC000078004768 260167580 /nfs/dbraw/zinc/16/75/80/260167580.db2.gz DMBBKYDHWDQXSM-SECBINFHSA-N 0 0 297.767 4.268 20 5 CIBDRN CSc1ccccc1[C@@H](C)Nc1ccc([N+](=O)[O-])cc1 ZINC000409642324 260419764 /nfs/dbraw/zinc/41/97/64/260419764.db2.gz UOFIEGXNRXFFIF-LLVKDONJSA-N 0 0 288.372 4.490 20 5 CIBDRN CC(C)(C)[C@H](Nc1ncc([N+](=O)[O-])s1)c1ccccc1 ZINC000409722238 260428228 /nfs/dbraw/zinc/42/82/28/260428228.db2.gz SUAPOTFNZYAXGG-GFCCVEGCSA-N 0 0 291.376 4.251 20 5 CIBDRN CC[C@H](Sc1ccc([N+](=O)[O-])cn1)c1ccc(F)cc1 ZINC000448103239 260837065 /nfs/dbraw/zinc/83/70/65/260837065.db2.gz PXPCDVNNCZAGCE-ZDUSSCGKSA-N 0 0 292.335 4.372 20 5 CIBDRN C[C@H](SCc1nccs1)c1cccc([N+](=O)[O-])c1 ZINC000161851869 261262313 /nfs/dbraw/zinc/26/23/13/261262313.db2.gz PRVLNSNOSCVMHA-VIFPVBQESA-N 0 0 280.374 4.046 20 5 CIBDRN CCc1ccc(NCc2ccc([N+](=O)[O-])cc2F)cc1C ZINC000314257008 261601817 /nfs/dbraw/zinc/60/18/17/261601817.db2.gz ZASPQDUZEZZYTP-UHFFFAOYSA-N 0 0 288.322 4.217 20 5 CIBDRN Cc1cccc(N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000020557589 262250896 /nfs/dbraw/zinc/25/08/96/262250896.db2.gz OYRHARQLWYVNFU-CYBMUJFWSA-N 0 0 270.332 4.385 20 5 CIBDRN Cc1ccc([C@@H](C)Nc2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000021062594 262375927 /nfs/dbraw/zinc/37/59/27/262375927.db2.gz DQAAPFNKXLITIW-SNVBAGLBSA-N 0 0 292.285 4.355 20 5 CIBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCCc3sccc32)c(F)c1 ZINC000061329093 262394323 /nfs/dbraw/zinc/39/43/23/262394323.db2.gz BHQTWQXYYYGBJU-GFCCVEGCSA-N 0 0 292.335 4.285 20 5 CIBDRN O=[N+]([O-])c1c(F)cccc1N[C@@H]1CCCc2sccc21 ZINC000061364265 262396490 /nfs/dbraw/zinc/39/64/90/262396490.db2.gz KHVCGDFQUDMEAH-LLVKDONJSA-N 0 0 292.335 4.285 20 5 CIBDRN CC(/C=C/c1ccc([N+](=O)[O-])cn1)=C\c1ccccc1 ZINC000439508892 263127337 /nfs/dbraw/zinc/12/73/37/263127337.db2.gz CYKJDGKDFYWKGZ-IGOCJVNJSA-N 0 0 266.300 4.107 20 5 CIBDRN COc1ccc([C@@H](C)Nc2cc(C)ccc2[N+](=O)[O-])cc1 ZINC000094659800 265248682 /nfs/dbraw/zinc/24/86/82/265248682.db2.gz DMQNFUQNCUDTOU-GFCCVEGCSA-N 0 0 286.331 4.085 20 5 CIBDRN CC1CCC(c2noc(-c3ccc([N+](=O)[O-])s3)n2)CC1 ZINC000356189433 266067671 /nfs/dbraw/zinc/06/76/71/266067671.db2.gz GBIQAIXKIYBIAA-UHFFFAOYSA-N 0 0 293.348 4.000 20 5 CIBDRN Cc1cc([C@@H](C)Nc2cccc(C)c2[N+](=O)[O-])c(C)o1 ZINC000218844423 327896325 /nfs/dbraw/zinc/89/63/25/327896325.db2.gz NXCUYHKJXPCRGZ-LLVKDONJSA-N 0 0 274.320 4.286 20 5 CIBDRN CC(C)(C)Oc1cc(N[C@@H]2CC[C@H](F)C2)ccc1[N+](=O)[O-] ZINC000571196941 328091830 /nfs/dbraw/zinc/09/18/30/328091830.db2.gz RNOULSMIXMMOPN-WDEREUQCSA-N 0 0 296.342 4.075 20 5 CIBDRN O=[N+]([O-])c1ccc(-c2csc(C3CCCC3)n2)cc1 ZINC000048640668 328314359 /nfs/dbraw/zinc/31/43/59/328314359.db2.gz NYRCRJSJQYZSOX-UHFFFAOYSA-N 0 0 274.345 4.376 20 5 CIBDRN CN(Cc1cccc([N+](=O)[O-])c1)c1cccc2ccccc21 ZINC000065590163 328316258 /nfs/dbraw/zinc/31/62/58/328316258.db2.gz CAVQIEVJUKUWBS-UHFFFAOYSA-N 0 0 292.338 4.384 20 5 CIBDRN O=[N+]([O-])c1cc(/C=C/c2ccc3ccccc3n2)cs1 ZINC000048578826 328317126 /nfs/dbraw/zinc/31/71/26/328317126.db2.gz KPJKWCYOOYVGMS-FNORWQNLSA-N 0 0 282.324 4.375 20 5 CIBDRN C[C@H](Sc1ccc([N+](=O)[O-])cn1)c1ccccc1Cl ZINC000049057550 328329963 /nfs/dbraw/zinc/32/99/63/328329963.db2.gz STJYHWUCKIHTNF-VIFPVBQESA-N 0 0 294.763 4.497 20 5 CIBDRN Cc1ccc(NCc2c(Cl)cccc2[N+](=O)[O-])c(C)c1 ZINC000111332829 328346164 /nfs/dbraw/zinc/34/61/64/328346164.db2.gz QKOBQTNIORNLLL-UHFFFAOYSA-N 0 0 290.750 4.477 20 5 CIBDRN O=[N+]([O-])c1cccc(Cl)c1CNc1cc(F)ccc1F ZINC000111333020 328346497 /nfs/dbraw/zinc/34/64/97/328346497.db2.gz FLCFGVUMWGFHEM-UHFFFAOYSA-N 0 0 298.676 4.139 20 5 CIBDRN Cc1cccc(C)c1NCc1c(Cl)cccc1[N+](=O)[O-] ZINC000111334098 328347492 /nfs/dbraw/zinc/34/74/92/328347492.db2.gz DBIKUMDKHLXZDU-UHFFFAOYSA-N 0 0 290.750 4.477 20 5 CIBDRN O=[N+]([O-])c1cccnc1S[C@H]1CCCc2ccccc21 ZINC000049418468 328361481 /nfs/dbraw/zinc/36/14/81/328361481.db2.gz RCWRLVNHGRWMAY-AWEZNQCLSA-N 0 0 286.356 4.160 20 5 CIBDRN CCC[C@H](CC)Nc1ccc([N+](=O)[O-])c2cccnc12 ZINC000050164861 328387583 /nfs/dbraw/zinc/38/75/83/328387583.db2.gz SLVQKGJJALFMBO-NSHDSACASA-N 0 0 273.336 4.134 20 5 CIBDRN Cc1cc([N+](=O)[O-])ccc1OCCCCC(F)(F)F ZINC000535120646 328388385 /nfs/dbraw/zinc/38/83/85/328388385.db2.gz OHDUZKOMYQNHJI-UHFFFAOYSA-N 0 0 277.242 4.015 20 5 CIBDRN Cc1c(CNc2ccc3ccn(C)c3c2)cccc1[N+](=O)[O-] ZINC000190615272 328496878 /nfs/dbraw/zinc/49/68/78/328496878.db2.gz YMLMGTUPSJGSQT-UHFFFAOYSA-N 0 0 295.342 4.007 20 5 CIBDRN Cc1ccc(N[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000037177008 326853023 /nfs/dbraw/zinc/85/30/23/326853023.db2.gz AHRFVOBQRWAPOR-GFCCVEGCSA-N 0 0 256.305 4.076 20 5 CIBDRN C[C@H](Nc1ccnc2c1cccc2[N+](=O)[O-])c1ccccc1 ZINC000317459281 327018866 /nfs/dbraw/zinc/01/88/66/327018866.db2.gz OPAUKUTZKHXZLU-LBPRGKRZSA-N 0 0 293.326 4.316 20 5 CIBDRN Cc1cc2cc(CNc3ccc([N+](=O)[O-])cc3C)ccc2[nH]1 ZINC000557727019 327023081 /nfs/dbraw/zinc/02/30/81/327023081.db2.gz AUHRVBOPUGSASI-UHFFFAOYSA-N 0 0 295.342 4.305 20 5 CIBDRN O=[N+]([O-])c1ccccc1OCc1cccc(C(F)(F)F)c1 ZINC000255931308 327032700 /nfs/dbraw/zinc/03/27/00/327032700.db2.gz ZJHCGLBKZCEULV-UHFFFAOYSA-N 0 0 297.232 4.193 20 5 CIBDRN O=[N+]([O-])c1cccc(F)c1OCc1cccc(F)c1Cl ZINC000558850097 327126828 /nfs/dbraw/zinc/12/68/28/327126828.db2.gz MDPXOTLNEMIULO-UHFFFAOYSA-N 0 0 299.660 4.105 20 5 CIBDRN Cc1cnccc1Sc1ccc(Cl)cc1[N+](=O)[O-] ZINC000558998766 327137637 /nfs/dbraw/zinc/13/76/37/327137637.db2.gz 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C[C@@H](Nc1ccc([N+](=O)[O-])cc1)c1c(F)cccc1F ZINC000037061514 333468926 /nfs/dbraw/zinc/46/89/26/333468926.db2.gz GWBADXSAHDCHOX-SECBINFHSA-N 0 0 278.258 4.046 20 5 CIBDRN COc1cc(C)ccc1N[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000037783239 333540090 /nfs/dbraw/zinc/54/00/90/333540090.db2.gz PWRKYLAFYJLVFX-GFCCVEGCSA-N 0 0 286.331 4.085 20 5 CIBDRN Cc1cscc1N[C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000538549710 333605328 /nfs/dbraw/zinc/60/53/28/333605328.db2.gz JBUNEBLHGSONJT-NSHDSACASA-N 0 0 276.361 4.446 20 5 CIBDRN Cc1ccc([C@H](C)NCc2ccc(Cl)o2)cc1[N+](=O)[O-] ZINC000539531354 333676904 /nfs/dbraw/zinc/67/69/04/333676904.db2.gz RJKHVYXKXAAGLP-JTQLQIEISA-N 0 0 294.738 4.000 20 5 CIBDRN C[C@H](Nc1cccc2c1OCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000540752884 333745717 /nfs/dbraw/zinc/74/57/17/333745717.db2.gz FQHIOZXQJHNOGU-LBPRGKRZSA-N 0 0 298.342 4.093 20 5 CIBDRN O=[N+]([O-])c1ccc(CSCc2ccco2)c(Cl)c1 ZINC000541075644 333761641 /nfs/dbraw/zinc/76/16/41/333761641.db2.gz LZXWAQOHLAGLJE-UHFFFAOYSA-N 0 0 283.736 4.275 20 5 CIBDRN O=[N+]([O-])c1ccc(COc2c(F)cccc2F)c(Cl)c1 ZINC000541079005 333761764 /nfs/dbraw/zinc/76/17/64/333761764.db2.gz SZVHWSMKQXJZOA-UHFFFAOYSA-N 0 0 299.660 4.105 20 5 CIBDRN CC[C@H](Oc1cccnc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000070766365 333826833 /nfs/dbraw/zinc/82/68/33/333826833.db2.gz RXUSJJRZALMCSE-LBPRGKRZSA-N 0 0 292.722 4.173 20 5 CIBDRN Cc1cccc(OCCCCC(F)(F)F)c1[N+](=O)[O-] ZINC000131266722 333917563 /nfs/dbraw/zinc/91/75/63/333917563.db2.gz QTFFPVOJKGSNGQ-UHFFFAOYSA-N 0 0 277.242 4.015 20 5 CIBDRN CC(C)c1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2)s1 ZINC000546152996 334016722 /nfs/dbraw/zinc/01/67/22/334016722.db2.gz GGQPPLXEPOCPQU-UHFFFAOYSA-N 0 0 290.344 4.032 20 5 CIBDRN Cc1cc([N+](=O)[O-])ccc1-c1noc([C@H](C)C(C)(C)C)n1 ZINC000546401650 334030874 /nfs/dbraw/zinc/03/08/74/334030874.db2.gz VSXFKWQQEDHALI-JTQLQIEISA-N 0 0 289.335 4.103 20 5 CIBDRN CC[C@H](CC(F)(F)F)Nc1ccc(C)cc1[N+](=O)[O-] ZINC000546882327 334053712 /nfs/dbraw/zinc/05/37/12/334053712.db2.gz 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C/C=C\c1ccc(NC(=O)c2c(C)cccc2[N+](=O)[O-])cc1 ZINC000568324022 334815081 /nfs/dbraw/zinc/81/50/81/334815081.db2.gz OFVPBAWDSCNXIP-HYXAFXHYSA-N 0 0 296.326 4.189 20 5 CIBDRN Cc1cc2cc(CNc3c(F)cccc3[N+](=O)[O-])ccc2[nH]1 ZINC000568780057 334840846 /nfs/dbraw/zinc/84/08/46/334840846.db2.gz IJEQIXLVCAKQHM-UHFFFAOYSA-N 0 0 299.305 4.136 20 5 CIBDRN O=[N+]([O-])c1cc(COc2c(F)cccc2Cl)cs1 ZINC000159214914 334855172 /nfs/dbraw/zinc/85/51/72/334855172.db2.gz ZAAZMXMXWACXEH-UHFFFAOYSA-N 0 0 287.699 4.028 20 5 CIBDRN CCc1nocc1CS[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000577232221 335327823 /nfs/dbraw/zinc/32/78/23/335327823.db2.gz XJRXSUUSKIIYCU-JTQLQIEISA-N 0 0 292.360 4.140 20 5 CIBDRN CCc1nocc1CS[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000577232222 335327837 /nfs/dbraw/zinc/32/78/37/335327837.db2.gz XJRXSUUSKIIYCU-SNVBAGLBSA-N 0 0 292.360 4.140 20 5 CIBDRN Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(C(C)C)cc1 ZINC000183951221 335913708 /nfs/dbraw/zinc/91/37/08/335913708.db2.gz DAFVVOXNQRATIU-UHFFFAOYSA-N 0 0 298.342 4.279 20 5 CIBDRN O=[N+]([O-])c1ccc(CSc2cccc(F)c2)c(F)c1 ZINC000382279531 336085285 /nfs/dbraw/zinc/08/52/85/336085285.db2.gz DADQSEIQPZRXKZ-UHFFFAOYSA-N 0 0 281.283 4.165 20 5 CIBDRN C[C@H](Nc1c(Cl)cccc1[N+](=O)[O-])c1cccc(O)c1 ZINC000383445974 336109255 /nfs/dbraw/zinc/10/92/55/336109255.db2.gz ALDRRXKVAPZJQV-VIFPVBQESA-N 0 0 292.722 4.127 20 5 CIBDRN Cc1c(CNc2cccc3c2CCCC3)cccc1[N+](=O)[O-] ZINC000386953536 336182881 /nfs/dbraw/zinc/18/28/81/336182881.db2.gz SNCAWHWDJXYMTC-UHFFFAOYSA-N 0 0 296.370 4.394 20 5 CIBDRN C[C@@H]1CCN(c2ccccc2[N+](=O)[O-])[C@H](c2ccco2)C1 ZINC000301464052 534058836 /nfs/dbraw/zinc/05/88/36/534058836.db2.gz WCJWMTDJAYOCEW-DOMZBBRYSA-N 0 0 286.331 4.165 20 5 CIBDRN CCOC1CC(CS[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000285013197 521649149 /nfs/dbraw/zinc/64/91/49/521649149.db2.gz HVECCZHMMKKZRU-XIKARTHZSA-N 0 0 295.404 4.204 20 5 CIBDRN Cc1sc(CNc2ccccc2[N+](=O)[O-])nc1C(C)C ZINC000347194870 534607753 /nfs/dbraw/zinc/60/77/53/534607753.db2.gz YWCFCVVQXYIXHM-UHFFFAOYSA-N 0 0 291.376 4.095 20 5 CIBDRN CC[C@@H](Nc1cc(C)c([N+](=O)[O-])cc1F)c1ccncc1 ZINC000292814298 522954422 /nfs/dbraw/zinc/95/44/22/522954422.db2.gz ZGCKUJLHQALMTE-CYBMUJFWSA-N 0 0 289.310 4.001 20 5 CIBDRN CCn1c(C)nc([N+](=O)[O-])c1SC1CCC(C)(C)CC1 ZINC000340855620 523145360 /nfs/dbraw/zinc/14/53/60/523145360.db2.gz MBSHFZRHSFPXOX-UHFFFAOYSA-N 0 0 297.424 4.181 20 5 CIBDRN Cc1cc(CS[C@@H](C)c2cc([N+](=O)[O-])ccc2C)on1 ZINC000272157888 524818311 /nfs/dbraw/zinc/81/83/11/524818311.db2.gz FIPOBHZLDYDEEY-NSHDSACASA-N 0 0 292.360 4.194 20 5 CIBDRN Cc1ccc([C@@H](C)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000037058977 525751708 /nfs/dbraw/zinc/75/17/08/525751708.db2.gz GJQKWSAVZUFKHX-GFCCVEGCSA-N 0 0 256.305 4.076 20 5 CIBDRN Cc1ccc([C@H](C)Nc2ncc([N+](=O)[O-])cc2Cl)s1 ZINC000227650109 525949268 /nfs/dbraw/zinc/94/92/68/525949268.db2.gz JYSBITVCTJDDGT-QMMMGPOBSA-N 0 0 297.767 4.186 20 5 CIBDRN CSc1ccc(CNc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000042304574 526006657 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170207905 /nfs/dbraw/zinc/20/79/05/170207905.db2.gz CAKHODWNGZPCGF-UHFFFAOYSA-N 0 0 299.355 4.072 20 5 CIBDRN Cc1ccc(C(C)C)cc1Oc1ncccc1[N+](=O)[O-] ZINC000007186336 170270229 /nfs/dbraw/zinc/27/02/29/170270229.db2.gz RTCZUIOKFRHYRD-UHFFFAOYSA-N 0 0 272.304 4.214 20 5 CIBDRN Cc1cc(C(=O)Nc2cccc(C(C)C)c2)ccc1[N+](=O)[O-] ZINC000007689911 170297654 /nfs/dbraw/zinc/29/76/54/170297654.db2.gz IOFBAPPCXWHUOV-UHFFFAOYSA-N 0 0 298.342 4.279 20 5 CIBDRN Cc1ccc(Cl)cc1NCc1ccc([N+](=O)[O-])cc1 ZINC000008728717 170350230 /nfs/dbraw/zinc/35/02/30/170350230.db2.gz BWGJXNOJNINONJ-UHFFFAOYSA-N 0 0 276.723 4.169 20 5 CIBDRN Cc1ccc(NCc2ccc([N+](=O)[O-])cc2)c(Cl)c1 ZINC000020314058 171145723 /nfs/dbraw/zinc/14/57/23/171145723.db2.gz ULRFDVLONKWOJR-UHFFFAOYSA-N 0 0 276.723 4.169 20 5 CIBDRN Cc1ccc(N[C@H](C)c2cccc([N+](=O)[O-])c2)c(F)c1 ZINC000020358702 171157267 /nfs/dbraw/zinc/15/72/67/171157267.db2.gz ZGMHYNIROOSLSZ-LLVKDONJSA-N 0 0 274.295 4.215 20 5 CIBDRN Cc1ccccc1N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000020526123 171239019 /nfs/dbraw/zinc/23/90/19/171239019.db2.gz YCYABNRHOJKLAH-LBPRGKRZSA-N 0 0 256.305 4.076 20 5 CIBDRN Cc1cccc(N[C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000020525890 171239039 /nfs/dbraw/zinc/23/90/39/171239039.db2.gz DVVVCLWPFSBABS-GFCCVEGCSA-N 0 0 256.305 4.076 20 5 CIBDRN CCc1ccc(N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000021008678 171285605 /nfs/dbraw/zinc/28/56/05/171285605.db2.gz IEHQSGXVHHZAID-GFCCVEGCSA-N 0 0 270.332 4.330 20 5 CIBDRN CCc1ccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000021008677 171285620 /nfs/dbraw/zinc/28/56/20/171285620.db2.gz IEHQSGXVHHZAID-LBPRGKRZSA-N 0 0 270.332 4.330 20 5 CIBDRN Cc1ccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1F ZINC000021801266 171326165 /nfs/dbraw/zinc/32/61/65/171326165.db2.gz JVVBAVOADAKNRK-NSHDSACASA-N 0 0 274.295 4.215 20 5 CIBDRN Cc1c(NCc2c(F)cccc2Cl)cccc1[N+](=O)[O-] ZINC000021901282 171336692 /nfs/dbraw/zinc/33/66/92/171336692.db2.gz BSBXWYLGMHBKPN-UHFFFAOYSA-N 0 0 294.713 4.308 20 5 CIBDRN Cc1cccc(CNc2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000035047098 171951104 /nfs/dbraw/zinc/95/11/04/171951104.db2.gz WIURLNKWZWJERH-UHFFFAOYSA-N 0 0 276.723 4.169 20 5 CIBDRN C[C@H]1CCCC[C@H]1Nc1ccc([N+](=O)[O-])c2ncccc12 ZINC000035084593 171971702 /nfs/dbraw/zinc/97/17/02/171971702.db2.gz XNZCLIIILVCBBD-WCQYABFASA-N 0 0 285.347 4.134 20 5 CIBDRN Cc1cccc(Nc2ccc3ncccc3c2[N+](=O)[O-])c1 ZINC000480399661 227207717 /nfs/dbraw/zinc/20/77/17/227207717.db2.gz ZJKNHXLWQYEFHI-UHFFFAOYSA-N 0 0 279.299 4.195 20 5 CIBDRN Cc1cc(Oc2ccc3ccccc3c2)ncc1[N+](=O)[O-] ZINC000301440494 227539875 /nfs/dbraw/zinc/53/98/75/227539875.db2.gz VGZVOCDXBITPSR-UHFFFAOYSA-N 0 0 280.283 4.244 20 5 CIBDRN Cc1ccc([C@H]2CCCCN2c2ccc([N+](=O)[O-])cn2)cc1 ZINC000301608277 227610387 /nfs/dbraw/zinc/61/03/87/227610387.db2.gz ZWTTVHBCWXHOKB-MRXNPFEDSA-N 0 0 297.358 4.030 20 5 CIBDRN Cc1ccc(N[C@@H]2CCCc3c(O)cccc32)c([N+](=O)[O-])c1 ZINC000302712237 227879240 /nfs/dbraw/zinc/87/92/40/227879240.db2.gz LDNRVFDGVPHVOD-CQSZACIVSA-N 0 0 298.342 4.098 20 5 CIBDRN C[C@H]1CCC[C@@H](N(C)c2ccc([N+](=O)[O-])c3cnccc32)C1 ZINC000519966656 260034107 /nfs/dbraw/zinc/03/41/07/260034107.db2.gz XDVIDGYRTRKSIC-QWHCGFSZSA-N 0 0 299.374 4.158 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)SCCOC(C)C ZINC000180703941 260109883 /nfs/dbraw/zinc/10/98/83/260109883.db2.gz FLNUWMZFMIBLLK-GFCCVEGCSA-N 0 0 283.393 4.122 20 5 CIBDRN Cc1cc(C)c(NCc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000037763710 260116527 /nfs/dbraw/zinc/11/65/27/260116527.db2.gz PKHHVVFVNOIAFL-UHFFFAOYSA-N 0 0 270.332 4.132 20 5 CIBDRN C[C@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000037764213 260116877 /nfs/dbraw/zinc/11/68/77/260116877.db2.gz KVMJXFUACQEDKT-RYUDHWBXSA-N 0 0 288.322 4.146 20 5 CIBDRN C[C@@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000037764215 260117100 /nfs/dbraw/zinc/11/71/00/260117100.db2.gz KVMJXFUACQEDKT-NEPJUHHUSA-N 0 0 288.322 4.146 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1NCc1cccc2cccnc21 ZINC000078531636 260167770 /nfs/dbraw/zinc/16/77/70/260167770.db2.gz GLMIZBIGAJQYFE-UHFFFAOYSA-N 0 0 293.326 4.064 20 5 CIBDRN Cc1cc(N[C@@H](C)c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000312613803 260182929 /nfs/dbraw/zinc/18/29/29/260182929.db2.gz UJRKIZRNBFASAT-NSHDSACASA-N 0 0 274.295 4.215 20 5 CIBDRN O=[N+]([O-])c1cccc2c1ccn2C[C@@H]1CCCC(F)(F)C1 ZINC000313154419 260253658 /nfs/dbraw/zinc/25/36/58/260253658.db2.gz WXJKYNVTKZWFSI-LLVKDONJSA-N 0 0 294.301 4.375 20 5 CIBDRN Cc1cnc(N[C@H](C)c2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000090692094 260261112 /nfs/dbraw/zinc/26/11/12/260261112.db2.gz NCWFYXCVLWIIAB-SNVBAGLBSA-N 0 0 291.738 4.125 20 5 CIBDRN Cc1cc(N[C@H](C)c2ccc(Cl)cc2)ncc1[N+](=O)[O-] ZINC000092026977 260266871 /nfs/dbraw/zinc/26/68/71/260266871.db2.gz MNZAGMPNMMDCIL-SNVBAGLBSA-N 0 0 291.738 4.125 20 5 CIBDRN Cc1ccc(C)c(NC(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000008370359 260346382 /nfs/dbraw/zinc/34/63/82/260346382.db2.gz DNVIPNKFFRBEHJ-UHFFFAOYSA-N 0 0 299.330 4.164 20 5 CIBDRN Cc1cnc(NCc2ccc(C(C)C)cc2)c([N+](=O)[O-])c1 ZINC000090692256 260382288 /nfs/dbraw/zinc/38/22/88/260382288.db2.gz OAXQUVAPPAYDMO-UHFFFAOYSA-N 0 0 285.347 4.034 20 5 CIBDRN CC(C)COCCS[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000409850301 260434159 /nfs/dbraw/zinc/43/41/59/260434159.db2.gz YJBJDYKZLNNXOX-LBPRGKRZSA-N 0 0 283.393 4.062 20 5 CIBDRN Cc1ccc(CNc2ccc3cc([N+](=O)[O-])ccc3n2)s1 ZINC000048337270 260655043 /nfs/dbraw/zinc/65/50/43/260655043.db2.gz URZORUMNXHOWCW-UHFFFAOYSA-N 0 0 299.355 4.125 20 5 CIBDRN Cc1cc(-c2ccc(F)cc2[N+](=O)[O-])nc2sccc21 ZINC000427456205 260741715 /nfs/dbraw/zinc/74/17/15/260741715.db2.gz ODIZNRJBTBBTBJ-UHFFFAOYSA-N 0 0 288.303 4.319 20 5 CIBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cn1)c1cccc(Cl)c1 ZINC000448098091 260833532 /nfs/dbraw/zinc/83/35/32/260833532.db2.gz STJOZFYXSRGTPZ-SECBINFHSA-N 0 0 294.763 4.497 20 5 CIBDRN Cc1nc(N[C@H](C)c2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000161502378 261062159 /nfs/dbraw/zinc/06/21/59/261062159.db2.gz VHFDXCOBRVZXQE-SECBINFHSA-N 0 0 291.738 4.125 20 5 CIBDRN CCO[C@H](C)c1nc(-c2ccc(C)c([N+](=O)[O-])c2)cs1 ZINC000174099763 261179565 /nfs/dbraw/zinc/17/95/65/261179565.db2.gz GLTZKJCSPDETHW-SNVBAGLBSA-N 0 0 292.360 4.124 20 5 CIBDRN CC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000008079680 261387337 /nfs/dbraw/zinc/38/73/37/261387337.db2.gz WYVGZLQXSJBHLE-UHFFFAOYSA-N 0 0 291.690 4.243 20 5 CIBDRN C[C@H]1CCCN1C(=O)c1cc2ccccc2c2cccnc12 ZINC000173125926 261522950 /nfs/dbraw/zinc/52/29/50/261522950.db2.gz RSFFOUGQQLXYRS-ZDUSSCGKSA-N 0 0 290.366 4.013 20 5 CIBDRN C[C@H]1CCCC[C@@H]1N(C)c1ccc([N+](=O)[O-])c2cnccc21 ZINC000497551084 262175081 /nfs/dbraw/zinc/17/50/81/262175081.db2.gz ZWLWUUWIQORZHE-WFASDCNBSA-N 0 0 299.374 4.158 20 5 CIBDRN Cc1ccc(C)c(N[C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000020526118 262244891 /nfs/dbraw/zinc/24/48/91/262244891.db2.gz UBSRFEBSZNTVRI-CYBMUJFWSA-N 0 0 270.332 4.385 20 5 CIBDRN Cc1ccc(N[C@H](C)c2ccccc2[N+](=O)[O-])c(C)c1 ZINC000020525892 262245124 /nfs/dbraw/zinc/24/51/24/262245124.db2.gz WZTVFPYFYXDIAA-CYBMUJFWSA-N 0 0 270.332 4.385 20 5 CIBDRN C[C@H](Nc1ccc2[nH]ccc2c1)c1ccccc1[N+](=O)[O-] ZINC000020526197 262246181 /nfs/dbraw/zinc/24/61/81/262246181.db2.gz XBRMLIWJKNONID-NSHDSACASA-N 0 0 281.315 4.249 20 5 CIBDRN Cc1ccc([C@@H](C)Nc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000020556781 262250863 /nfs/dbraw/zinc/25/08/63/262250863.db2.gz ZDXDAQFWTWFANJ-LLVKDONJSA-N 0 0 274.295 4.215 20 5 CIBDRN O=[N+]([O-])c1ccccc1N[C@@H]1CCCc2sccc21 ZINC000061327114 262394129 /nfs/dbraw/zinc/39/41/29/262394129.db2.gz OVOSTYIVLBQEFB-LLVKDONJSA-N 0 0 274.345 4.146 20 5 CIBDRN O=[N+]([O-])c1ccc(N[C@H]2CCCc3sccc32)c(F)c1 ZINC000061329096 262394181 /nfs/dbraw/zinc/39/41/81/262394181.db2.gz BHQTWQXYYYGBJU-LBPRGKRZSA-N 0 0 292.335 4.285 20 5 CIBDRN CC(=C\c1ccccc1)/C=C\c1ccc([N+](=O)[O-])cn1 ZINC000439508891 263127348 /nfs/dbraw/zinc/12/73/48/263127348.db2.gz CYKJDGKDFYWKGZ-DYYHYMPESA-N 0 0 266.300 4.107 20 5 CIBDRN Cc1ccc([N+](=O)[O-])c(N[C@H](C)c2cc3ccccc3o2)n1 ZINC000342439562 263434630 /nfs/dbraw/zinc/43/46/30/263434630.db2.gz PUDZJYSOKJRCGR-LLVKDONJSA-N 0 0 297.314 4.218 20 5 CIBDRN Cc1ccc([N+](=O)[O-])c(N[C@@H]2CSc3ccccc32)c1 ZINC000157395531 264349068 /nfs/dbraw/zinc/34/90/68/264349068.db2.gz XQNYBIVXWBSKMG-CYBMUJFWSA-N 0 0 286.356 4.162 20 5 CIBDRN Cc1occc1SCc1cccc([N+](=O)[O-])c1C ZINC000357097565 266246998 /nfs/dbraw/zinc/24/69/98/266246998.db2.gz XZVRMVOTLYFZQJ-UHFFFAOYSA-N 0 0 263.318 4.097 20 5 CIBDRN Cc1occc1S[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000358806543 266495003 /nfs/dbraw/zinc/49/50/03/266495003.db2.gz XDQYUHBSDNUELR-JTQLQIEISA-N 0 0 263.318 4.350 20 5 CIBDRN Cc1cc(-c2noc(C3CC4(CCC4)C3)n2)cc([N+](=O)[O-])c1 ZINC000563123698 327927134 /nfs/dbraw/zinc/92/71/34/327927134.db2.gz SMOLBRMWHXBFEX-UHFFFAOYSA-N 0 0 299.330 4.001 20 5 CIBDRN CCc1ccc(NCc2cccc([N+](=O)[O-])c2)cc1C ZINC000380179067 327945699 /nfs/dbraw/zinc/94/56/99/327945699.db2.gz BAAWTLSOEYOXTK-UHFFFAOYSA-N 0 0 270.332 4.078 20 5 CIBDRN O=[N+]([O-])c1cc(F)ccc1N[C@H](c1ccccc1)C1CC1 ZINC000041064182 328025461 /nfs/dbraw/zinc/02/54/61/328025461.db2.gz HJAXFKAKLKXTSQ-MRXNPFEDSA-N 0 0 286.306 4.297 20 5 CIBDRN O=[N+]([O-])c1ccc(NCc2csc3ccccc23)cc1 ZINC000048337132 328053363 /nfs/dbraw/zinc/05/33/63/328053363.db2.gz OJMVWBZVXGRAFF-UHFFFAOYSA-N 0 0 284.340 4.422 20 5 CIBDRN Cc1cc(N[C@H](C)Cc2ccsc2)ccc1[N+](=O)[O-] ZINC000048553076 328312253 /nfs/dbraw/zinc/31/22/53/328312253.db2.gz UJIFOHSAKQOAIJ-LLVKDONJSA-N 0 0 276.361 4.008 20 5 CIBDRN Cc1cc(NCCc2ccc(Cl)s2)ccc1[N+](=O)[O-] ZINC000048561552 328314918 /nfs/dbraw/zinc/31/49/18/328314918.db2.gz QMNGHYWBBQRDCH-UHFFFAOYSA-N 0 0 296.779 4.273 20 5 CIBDRN O=[N+]([O-])c1cc(F)c(CNc2cccc(Cl)c2)c(F)c1 ZINC000506275071 332768094 /nfs/dbraw/zinc/76/80/94/332768094.db2.gz ZDIDBOCMDZCGTF-UHFFFAOYSA-N 0 0 298.676 4.139 20 5 CIBDRN Cc1ccc(NCc2c(Cl)cccc2[N+](=O)[O-])c(F)c1 ZINC000111333331 328347307 /nfs/dbraw/zinc/34/73/07/328347307.db2.gz PLSSRPRKHJUIJZ-UHFFFAOYSA-N 0 0 294.713 4.308 20 5 CIBDRN Cc1ccc(NCc2ccc([N+](=O)[O-])cc2Cl)c(F)c1 ZINC000049963282 328380106 /nfs/dbraw/zinc/38/01/06/328380106.db2.gz UPEPBICGUVAKIH-UHFFFAOYSA-N 0 0 294.713 4.308 20 5 CIBDRN CCC[C@H](CC)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000050165019 328388010 /nfs/dbraw/zinc/38/80/10/328388010.db2.gz WONURLXGKUAOHB-NSHDSACASA-N 0 0 273.336 4.134 20 5 CIBDRN Cc1ccc(OCc2csc(C(C)C)n2)cc1[N+](=O)[O-] ZINC000535120580 328388565 /nfs/dbraw/zinc/38/85/65/328388565.db2.gz NRAHRRSOZRDOCO-UHFFFAOYSA-N 0 0 292.360 4.062 20 5 CIBDRN Cc1cc([N+](=O)[O-])cnc1NCc1cc2ccccc2s1 ZINC000583516543 328597177 /nfs/dbraw/zinc/59/71/77/328597177.db2.gz BPZOUHCRTKTTQS-UHFFFAOYSA-N 0 0 299.355 4.125 20 5 CIBDRN Cc1cc(N[C@@H](C)Cc2ccccc2F)ccc1[N+](=O)[O-] ZINC000064915380 326886823 /nfs/dbraw/zinc/88/68/23/326886823.db2.gz MPESSFJNASVWKF-LBPRGKRZSA-N 0 0 288.322 4.085 20 5 CIBDRN Cc1cccc(OCc2cccc(Cl)c2)c1[N+](=O)[O-] ZINC000557966709 327037962 /nfs/dbraw/zinc/03/79/62/327037962.db2.gz FURZLOBKBSEQFZ-UHFFFAOYSA-N 0 0 277.707 4.136 20 5 CIBDRN Cc1cnc(NCc2ccc3sccc3c2)c([N+](=O)[O-])c1 ZINC000558598996 327108256 /nfs/dbraw/zinc/10/82/56/327108256.db2.gz KIDKHIVPTOYQKD-UHFFFAOYSA-N 0 0 299.355 4.125 20 5 CIBDRN Cc1cc(NCC(C)(C)C(F)(F)F)c(F)cc1[N+](=O)[O-] ZINC000564639656 327121011 /nfs/dbraw/zinc/12/10/11/327121011.db2.gz KTOCWAMUACRPOU-UHFFFAOYSA-N 0 0 294.248 4.043 20 5 CIBDRN O=[N+]([O-])c1ccc(C(F)(F)F)c(CSCC2CC2)c1 ZINC000558847220 327125922 /nfs/dbraw/zinc/12/59/22/327125922.db2.gz GLBIFWPVLBRDQP-UHFFFAOYSA-N 0 0 291.294 4.257 20 5 CIBDRN C[C@@H](Nc1cccc2ccncc21)c1ccc([N+](=O)[O-])cc1 ZINC000316596065 327175913 /nfs/dbraw/zinc/17/59/13/327175913.db2.gz TYYJILXOVVMDCH-GFCCVEGCSA-N 0 0 293.326 4.316 20 5 CIBDRN C[C@@H](Sc1ccc(O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000047895183 327227919 /nfs/dbraw/zinc/22/79/19/327227919.db2.gz UWUNBIJAXWJWIA-SNVBAGLBSA-N 0 0 275.329 4.154 20 5 CIBDRN O=[N+]([O-])c1cccc(F)c1N1CCC[C@H]1c1ccsc1 ZINC000561122672 327367756 /nfs/dbraw/zinc/36/77/56/327367756.db2.gz URDRBNFEGZSPIG-LBPRGKRZSA-N 0 0 292.335 4.137 20 5 CIBDRN O=[N+]([O-])c1ccccc1N1CC[C@H]1c1ccc(Cl)cc1 ZINC000561357453 327388875 /nfs/dbraw/zinc/38/88/75/327388875.db2.gz BVBAFBTZTVGDIE-ZDUSSCGKSA-N 0 0 288.734 4.200 20 5 CIBDRN C[C@H](Sc1ccc([N+](=O)[O-])cn1)c1ccc(F)cc1F ZINC000160350578 327605920 /nfs/dbraw/zinc/60/59/20/327605920.db2.gz CHJHOQDYDQWFJC-QMMMGPOBSA-N 0 0 296.298 4.121 20 5 CIBDRN CCc1nocc1CS[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000570696794 327611916 /nfs/dbraw/zinc/61/19/16/327611916.db2.gz UPSUZAGWACUCDB-SNVBAGLBSA-N 0 0 292.360 4.140 20 5 CIBDRN Cc1c(F)cccc1N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000043319938 328786536 /nfs/dbraw/zinc/78/65/36/328786536.db2.gz KKOIAZLTSNKGKN-NSHDSACASA-N 0 0 274.295 4.215 20 5 CIBDRN C[C@H](Nc1ncccc1[N+](=O)[O-])c1cc2ccccc2s1 ZINC000301166924 328827200 /nfs/dbraw/zinc/82/72/00/328827200.db2.gz CKYLHTGRGYFOBC-JTQLQIEISA-N 0 0 299.355 4.378 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)SCc1nccs1 ZINC000180715558 329222467 /nfs/dbraw/zinc/22/24/67/329222467.db2.gz UUQKNRWOQRJWSC-SNVBAGLBSA-N 0 0 294.401 4.354 20 5 CIBDRN O=[N+]([O-])c1ccc(N[C@H]2CCCC[C@@H]2c2ccccc2)cn1 ZINC000582868924 329278574 /nfs/dbraw/zinc/27/85/74/329278574.db2.gz NRSOPECTVWTXNV-CVEARBPZSA-N 0 0 297.358 4.128 20 5 CIBDRN Cc1cccc(OC[C@H]2CCCC(F)(F)C2)c1[N+](=O)[O-] ZINC000509088804 332858866 /nfs/dbraw/zinc/85/88/66/332858866.db2.gz FWZCJCFFCVJTQQ-NSHDSACASA-N 0 0 285.290 4.108 20 5 CIBDRN C[C@H](Nc1ccc([N+](=O)[O-])cn1)c1ccc(C2CC2)cc1 ZINC000419010652 329705718 /nfs/dbraw/zinc/70/57/18/329705718.db2.gz YHWWXXCOMGQISD-NSHDSACASA-N 0 0 283.331 4.040 20 5 CIBDRN O=[N+]([O-])c1cc(Cl)ccc1N1CC2(CCC2)[C@@H]1C1CC1 ZINC000572086396 329942916 /nfs/dbraw/zinc/94/29/16/329942916.db2.gz LYPZUMWZKWBJFO-AWEZNQCLSA-N 0 0 292.766 4.017 20 5 CIBDRN C[C@H](Sc1ccccc1O)c1cccc([N+](=O)[O-])c1 ZINC000161754308 329954398 /nfs/dbraw/zinc/95/43/98/329954398.db2.gz LNYSCHUWQLUVSE-JTQLQIEISA-N 0 0 275.329 4.154 20 5 CIBDRN CC[C@H](Nc1ccc2c(c1)CCN2)c1cccc([N+](=O)[O-])c1 ZINC000423212681 330177918 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330501496 /nfs/dbraw/zinc/50/14/96/330501496.db2.gz DATRIPVRULNVPI-UHFFFAOYSA-N 0 0 299.286 4.028 20 5 CIBDRN C[C@H](SCCC1CC1)c1ccccc1[N+](=O)[O-] ZINC000437924532 330711136 /nfs/dbraw/zinc/71/11/36/330711136.db2.gz ZUUXJRFZXHJMQJ-JTQLQIEISA-N 0 0 251.351 4.189 20 5 CIBDRN C[C@@H](CSCc1cccc([N+](=O)[O-])c1)C(F)(F)F ZINC000439020207 330732462 /nfs/dbraw/zinc/73/24/62/330732462.db2.gz MXCZLAHUOHNMNP-QMMMGPOBSA-N 0 0 279.283 4.026 20 5 CIBDRN CC(C)=CCSc1ccc([N+](=O)[O-])c2cnccc12 ZINC000447686050 330874238 /nfs/dbraw/zinc/87/42/38/330874238.db2.gz COYVXFWPWKEWJF-UHFFFAOYSA-N 0 0 274.345 4.201 20 5 CIBDRN CC(F)(F)CCOc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000450914170 331006930 /nfs/dbraw/zinc/00/69/30/331006930.db2.gz NNCAKCDABIYWNL-UHFFFAOYSA-N 0 0 299.195 4.038 20 5 CIBDRN Cc1nc(C(C)C)ccc1CNc1cccc([N+](=O)[O-])c1 ZINC000453062959 331085654 /nfs/dbraw/zinc/08/56/54/331085654.db2.gz RJDFGOPJFCORQK-UHFFFAOYSA-N 0 0 285.347 4.034 20 5 CIBDRN CC[C@H](Nc1ncc([N+](=O)[O-])s1)c1ccc(Cl)cc1 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AFWQPOKLXSVYFM-QMMMGPOBSA-N 0 0 297.767 4.186 20 5 CIBDRN CC[C@H](C)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000134962684 334109602 /nfs/dbraw/zinc/10/96/02/334109602.db2.gz KLZQATRDAWENCZ-VIFPVBQESA-N 0 0 262.334 4.232 20 5 CIBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C[C@H](C)CC(C)C ZINC000086624393 334313955 /nfs/dbraw/zinc/31/39/55/334313955.db2.gz REXKLYPJFMOSOC-LLVKDONJSA-N 0 0 292.379 4.222 20 5 CIBDRN Cc1nc(CSCc2cccc([N+](=O)[O-])c2)sc1C ZINC000088305762 334335730 /nfs/dbraw/zinc/33/57/30/334335730.db2.gz RWQKPCFPIGJOEP-UHFFFAOYSA-N 0 0 294.401 4.102 20 5 CIBDRN O=[N+]([O-])c1cccc(F)c1Oc1ccc2ncccc2c1 ZINC000553339461 334378987 /nfs/dbraw/zinc/37/89/87/334378987.db2.gz ILJCFVDGZGLJMJ-UHFFFAOYSA-N 0 0 284.246 4.074 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)Sc1ncccc1C ZINC000553513665 334389358 /nfs/dbraw/zinc/38/93/58/334389358.db2.gz LTFLWIIGTFQPFQ-GFCCVEGCSA-N 0 0 288.372 4.460 20 5 CIBDRN C/C=C\c1ccc(NC(=O)c2cccc(C)c2[N+](=O)[O-])cc1 ZINC000553667414 334395159 /nfs/dbraw/zinc/39/51/59/334395159.db2.gz VBQDROPQHSNQGR-HYXAFXHYSA-N 0 0 296.326 4.189 20 5 CIBDRN O=[N+]([O-])c1ccc(Oc2cc(Cl)ccc2Cl)cn1 ZINC000555871837 334490843 /nfs/dbraw/zinc/49/08/43/334490843.db2.gz DOGIAGICNOZUIT-UHFFFAOYSA-N 0 0 285.086 4.089 20 5 CIBDRN Cc1nc(CS[C@H](C)c2cc([N+](=O)[O-])ccc2C)co1 ZINC000565225683 334546222 /nfs/dbraw/zinc/54/62/22/334546222.db2.gz VGYCLNACRGRIEO-SNVBAGLBSA-N 0 0 292.360 4.194 20 5 CIBDRN CCCN(c1ccc([N+](=O)[O-])nc1)[C@H](CC)c1ccccc1 ZINC000579158301 335716931 /nfs/dbraw/zinc/71/69/31/335716931.db2.gz TUXJASVZFOYCDQ-MRXNPFEDSA-N 0 0 299.374 4.358 20 5 CIBDRN COc1cccc(N[C@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000182656639 335834489 /nfs/dbraw/zinc/83/44/89/335834489.db2.gz YZNQHTYXLDTRQJ-GFCCVEGCSA-N 0 0 286.331 4.085 20 5 CIBDRN C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc(C2CCCC2)no1 ZINC000184844476 335936338 /nfs/dbraw/zinc/93/63/38/335936338.db2.gz QEHKSKBCOQISRV-KHPPLWFESA-N 0 0 299.330 4.196 20 5 CIBDRN CC(F)(F)CCNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000381947998 336078758 /nfs/dbraw/zinc/07/87/58/336078758.db2.gz VVXUFZQLLBZEON-UHFFFAOYSA-N 0 0 298.211 4.071 20 5 CIBDRN CCC1([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCCC1 ZINC000382534266 336092795 /nfs/dbraw/zinc/09/27/95/336092795.db2.gz BENSYJSICSVSEL-UHFFFAOYSA-N 0 0 282.771 4.061 20 5 CIBDRN CC[C@@H](Nc1ncc([N+](=O)[O-])cc1Cl)c1cccs1 ZINC000226806399 522967169 /nfs/dbraw/zinc/96/71/69/522967169.db2.gz UEWWNHMXBLBDFG-SNVBAGLBSA-N 0 0 297.767 4.268 20 5 CIBDRN CC[C@H]1CCN1C(=O)c1cc2ccccc2c2cccnc12 ZINC000297803499 523173680 /nfs/dbraw/zinc/17/36/80/523173680.db2.gz LCGKPTXPAXWTHD-AWEZNQCLSA-N 0 0 290.366 4.013 20 5 CIBDRN Cc1cccc(OCCSc2ccc([N+](=O)[O-])cc2)c1 ZINC000058690527 524752339 /nfs/dbraw/zinc/75/23/39/524752339.db2.gz YTSKMONVDWZGED-UHFFFAOYSA-N 0 0 289.356 4.074 20 5 CIBDRN Cc1cc([C@H](C)N[C@@H](C)c2ccccc2[N+](=O)[O-])c(C)o1 ZINC000044729600 525524917 /nfs/dbraw/zinc/52/49/17/525524917.db2.gz QSGAXTPXUREFBQ-RYUDHWBXSA-N 0 0 288.347 4.216 20 5 CIBDRN Cc1cc([C@H](C)Nc2ccc([N+](=O)[O-])cc2F)c(C)o1 ZINC000044422025 525534544 /nfs/dbraw/zinc/53/45/44/525534544.db2.gz JZRCQYHYUNWSKH-VIFPVBQESA-N 0 0 278.283 4.117 20 5 CIBDRN C[C@@H](Oc1ccc([N+](=O)[O-])cc1)c1ncc(C(C)(C)C)o1 ZINC000089124118 525934860 /nfs/dbraw/zinc/93/48/60/525934860.db2.gz OIGJVCNQZOWVCE-SNVBAGLBSA-N 0 0 290.319 4.020 20 5 CIBDRN O=[N+]([O-])c1cc(Cl)ccc1CSc1ccc(O)cc1 ZINC000050444897 527334748 /nfs/dbraw/zinc/33/47/48/527334748.db2.gz JUJHUVHVFRMTDB-UHFFFAOYSA-N 0 0 295.747 4.246 20 5 CIBDRN CCOc1ccc(Oc2c(F)cc([N+](=O)[O-])cc2F)cc1 ZINC000301800720 528572186 /nfs/dbraw/zinc/57/21/86/528572186.db2.gz SUFQLJSUGMQNPM-UHFFFAOYSA-N 0 0 295.241 4.064 20 5 CIBDRN Cc1ccc(Cl)cc1NCc1csc([N+](=O)[O-])c1 ZINC000037562395 184540773 /nfs/dbraw/zinc/54/07/73/184540773.db2.gz YAYHICSIBUAGOH-UHFFFAOYSA-N 0 0 282.752 4.230 20 5 CIBDRN O=[N+]([O-])c1cccc(COc2cc(Cl)ccc2Cl)c1 ZINC000058022828 256811440 /nfs/dbraw/zinc/81/14/40/256811440.db2.gz BVNRUTYOHDVXPS-UHFFFAOYSA-N 0 0 298.125 4.481 20 5 CIBDRN C[C@@H](Nc1cc(C2CC2)ccn1)c1cccc([N+](=O)[O-])c1 ZINC000353578753 533551166 /nfs/dbraw/zinc/55/11/66/533551166.db2.gz SDELWAIHBPHXPD-LLVKDONJSA-N 0 0 283.331 4.040 20 5 CIBDRN CC(C)c1ccc(NC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000006346925 170194674 /nfs/dbraw/zinc/19/46/74/170194674.db2.gz UEAZDPGYPIBTMB-UHFFFAOYSA-N 0 0 299.330 4.362 20 5 CIBDRN O=[N+]([O-])c1cccc(-c2csc(-c3cccs3)n2)c1 ZINC000006671477 170224879 /nfs/dbraw/zinc/22/48/79/170224879.db2.gz MMFLOGOHXGEVBI-UHFFFAOYSA-N 0 0 288.353 4.447 20 5 CIBDRN O=[N+]([O-])c1ccccc1N[C@@H]1CCSc2ccccc21 ZINC000007186755 170270286 /nfs/dbraw/zinc/27/02/86/170270286.db2.gz REZIIGMJYDYDSO-GFCCVEGCSA-N 0 0 286.356 4.244 20 5 CIBDRN COc1ccc(Sc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000008040550 170316064 /nfs/dbraw/zinc/31/60/64/170316064.db2.gz ZJYSDPYTWVACGK-UHFFFAOYSA-N 0 0 295.747 4.408 20 5 CIBDRN O=[N+]([O-])c1ccc(CNc2ccc3ccccc3c2)cc1 ZINC000008701786 170347117 /nfs/dbraw/zinc/34/71/17/170347117.db2.gz JLWDYEQKOKIUIO-UHFFFAOYSA-N 0 0 278.311 4.360 20 5 CIBDRN Cc1ccccc1CNc1ccc([N+](=O)[O-])cc1Cl ZINC000018901138 170751059 /nfs/dbraw/zinc/75/10/59/170751059.db2.gz NIMKFFMOXPJSDV-UHFFFAOYSA-N 0 0 276.723 4.169 20 5 CIBDRN Cc1cccc(N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000021812783 171330233 /nfs/dbraw/zinc/33/02/33/171330233.db2.gz IOIMPMAAPUZMFW-ZDUSSCGKSA-N 0 0 270.332 4.385 20 5 CIBDRN C[C@@H](Nc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000025278353 171452713 /nfs/dbraw/zinc/45/27/13/171452713.db2.gz PXUSWCBQIMABTB-SECBINFHSA-N 0 0 278.258 4.046 20 5 CIBDRN CCCc1ccccc1NC(=O)c1cccc([N+](=O)[O-])c1C ZINC000032079266 171695518 /nfs/dbraw/zinc/69/55/18/171695518.db2.gz ZGGVTIKOGJCJRZ-UHFFFAOYSA-N 0 0 298.342 4.108 20 5 CIBDRN Cc1cccc(NCc2cccc([N+](=O)[O-])c2C)c1C ZINC000035648806 172325332 /nfs/dbraw/zinc/32/53/32/172325332.db2.gz SVTJUDWDWGXQAQ-UHFFFAOYSA-N 0 0 270.332 4.132 20 5 CIBDRN Cc1c(CNc2ccc(F)cc2Cl)cccc1[N+](=O)[O-] ZINC000035648877 172325371 /nfs/dbraw/zinc/32/53/71/172325371.db2.gz FKEDIRCRRGIXSL-UHFFFAOYSA-N 0 0 294.713 4.308 20 5 CIBDRN CC[C@H](Nc1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000036721117 172657980 /nfs/dbraw/zinc/65/79/80/172657980.db2.gz PBLJAMJAJKBWQD-INIZCTEOSA-N 0 0 286.331 4.167 20 5 CIBDRN C[C@@H](Nc1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000037176932 173010843 /nfs/dbraw/zinc/01/08/43/173010843.db2.gz UQKSNGREENVLGP-SNVBAGLBSA-N 0 0 276.723 4.421 20 5 CIBDRN Cc1ccccc1COc1ccc(Cl)cc1[N+](=O)[O-] ZINC000072100000 176315341 /nfs/dbraw/zinc/31/53/41/176315341.db2.gz WWQMQDOLDCUMMQ-UHFFFAOYSA-N 0 0 277.707 4.136 20 5 CIBDRN C[C@H](Sc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000072121287 176319936 /nfs/dbraw/zinc/31/99/36/176319936.db2.gz WAEIWJPQMCYQEE-NSHDSACASA-N 0 0 259.330 4.448 20 5 CIBDRN Cc1ncccc1/C=C\c1nc2cc([N+](=O)[O-])ccc2s1 ZINC000349029388 226538423 /nfs/dbraw/zinc/53/84/23/226538423.db2.gz CKRYHCVXAHCRFH-DAXSKMNVSA-N 0 0 297.339 4.078 20 5 CIBDRN Cc1ccc([N+](=O)[O-])c(Oc2ccc3ncccc3c2)c1 ZINC000301577986 227595120 /nfs/dbraw/zinc/59/51/20/227595120.db2.gz RPBURRHFVCCQGT-UHFFFAOYSA-N 0 0 280.283 4.244 20 5 CIBDRN Cc1cc(C)cc([C@@H](C)Nc2ccc([N+](=O)[O-])c(C)n2)c1 ZINC000301680749 227638966 /nfs/dbraw/zinc/63/89/66/227638966.db2.gz VATKZWLILBNLJV-GFCCVEGCSA-N 0 0 285.347 4.088 20 5 CIBDRN Cc1cccc([N+](=O)[O-])c1NC1CCC(OC(C)C)CC1 ZINC000301767512 227670174 /nfs/dbraw/zinc/67/01/74/227670174.db2.gz IDTNDUDGSGCLLQ-UHFFFAOYSA-N 0 0 292.379 4.051 20 5 CIBDRN Cc1ccc(NC2CCC(OC(C)C)CC2)c([N+](=O)[O-])c1 ZINC000301781843 227676331 /nfs/dbraw/zinc/67/63/31/227676331.db2.gz SNMRUFVUYDMPEM-UHFFFAOYSA-N 0 0 292.379 4.051 20 5 CIBDRN Cc1cc([N+](=O)[O-])cc(Cl)c1N[C@@H](C)c1ccccn1 ZINC000302784297 227886956 /nfs/dbraw/zinc/88/69/56/227886956.db2.gz UOIVTJWNLFEFNC-JTQLQIEISA-N 0 0 291.738 4.125 20 5 CIBDRN Cc1ccc(N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000447584290 260065841 /nfs/dbraw/zinc/06/58/41/260065841.db2.gz FLFOJXOWAKGECB-QGZVFWFLSA-N 0 0 282.343 4.393 20 5 CIBDRN CC(=O)c1ccc(OCCCC(C)(C)C)c([N+](=O)[O-])c1 ZINC000312555956 260148496 /nfs/dbraw/zinc/14/84/96/260148496.db2.gz SFBNCIFJIYYQCG-UHFFFAOYSA-N 0 0 279.336 4.003 20 5 CIBDRN Cc1cnc(N[C@@H](C)c2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000090692187 260261240 /nfs/dbraw/zinc/26/12/40/260261240.db2.gz LYFGLTKXIAQKAW-JTQLQIEISA-N 0 0 291.738 4.125 20 5 CIBDRN Cc1cc(N[C@@H](C)c2ccccc2Cl)ncc1[N+](=O)[O-] ZINC000092026973 260266874 /nfs/dbraw/zinc/26/68/74/260266874.db2.gz HITYTVPSMCLEEN-JTQLQIEISA-N 0 0 291.738 4.125 20 5 CIBDRN Cc1ccc(C)c(NC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000008370306 260346405 /nfs/dbraw/zinc/34/64/05/260346405.db2.gz BVEGGTWWWSJSBE-UHFFFAOYSA-N 0 0 299.330 4.164 20 5 CIBDRN Cc1cc([C@@H](C)Nc2c(F)cccc2[N+](=O)[O-])c(C)o1 ZINC000132457118 260499515 /nfs/dbraw/zinc/49/95/15/260499515.db2.gz HTBMDJWHYRADDZ-SECBINFHSA-N 0 0 278.283 4.117 20 5 CIBDRN O=[N+]([O-])c1cccc2c1ccn2Cc1ccc2c(c1)CCC2 ZINC000318536553 261238717 /nfs/dbraw/zinc/23/87/17/261238717.db2.gz FVRZQMMLTXETEW-UHFFFAOYSA-N 0 0 292.338 4.087 20 5 CIBDRN CC(C)c1cccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000514340431 261660180 /nfs/dbraw/zinc/66/01/80/261660180.db2.gz IZDHSHQJCALTBE-UHFFFAOYSA-N 0 0 299.330 4.362 20 5 CIBDRN Cc1cc(CS[C@@H](C)c2cc([N+](=O)[O-])ccc2C)no1 ZINC000180687769 261871087 /nfs/dbraw/zinc/87/10/87/261871087.db2.gz OHFLXULLIUYJIQ-NSHDSACASA-N 0 0 292.360 4.194 20 5 CIBDRN Cc1c(COc2cccc3cccnc32)cccc1[N+](=O)[O-] ZINC000318878246 262091911 /nfs/dbraw/zinc/09/19/11/262091911.db2.gz ABIMILBSUMGEKO-UHFFFAOYSA-N 0 0 294.310 4.030 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C(C)C)cc1 ZINC000497190990 262096886 /nfs/dbraw/zinc/09/68/86/262096886.db2.gz NMIBQAJSDPLUBX-UHFFFAOYSA-N 0 0 298.342 4.279 20 5 CIBDRN Cc1cccc(N[C@H](C)c2ccccc2[N+](=O)[O-])c1C ZINC000020526114 262245264 /nfs/dbraw/zinc/24/52/64/262245264.db2.gz JUYBHHQYQTUUQA-CYBMUJFWSA-N 0 0 270.332 4.385 20 5 CIBDRN C[C@@H](Nc1ccc2[nH]ccc2c1)c1ccccc1[N+](=O)[O-] ZINC000020526196 262246056 /nfs/dbraw/zinc/24/60/56/262246056.db2.gz XBRMLIWJKNONID-LLVKDONJSA-N 0 0 281.315 4.249 20 5 CIBDRN O=[N+]([O-])c1cc(F)ccc1N[C@H]1CCCc2sccc21 ZINC000061326413 262394274 /nfs/dbraw/zinc/39/42/74/262394274.db2.gz ZOPYQMMUKQFXAZ-NSHDSACASA-N 0 0 292.335 4.285 20 5 CIBDRN O=[N+]([O-])c1ccccc1N[C@H]1CCCc2sccc21 ZINC000061327116 262394391 /nfs/dbraw/zinc/39/43/91/262394391.db2.gz OVOSTYIVLBQEFB-NSHDSACASA-N 0 0 274.345 4.146 20 5 CIBDRN Cc1ccc(CNc2cccc3cccnc32)cc1[N+](=O)[O-] ZINC000123686003 262508393 /nfs/dbraw/zinc/50/83/93/262508393.db2.gz HMERACIKSVNROY-UHFFFAOYSA-N 0 0 293.326 4.064 20 5 CIBDRN Cc1c(Oc2nc3ccccc3s2)cccc1[N+](=O)[O-] ZINC000048566156 263823692 /nfs/dbraw/zinc/82/36/92/263823692.db2.gz YJAKUSILLNGZHA-UHFFFAOYSA-N 0 0 286.312 4.305 20 5 CIBDRN O=[N+]([O-])c1cc(Cl)ccc1Sc1cccc(O)c1 ZINC000131034694 264366002 /nfs/dbraw/zinc/36/60/02/264366002.db2.gz TYDJWYSUAIZXFH-UHFFFAOYSA-N 0 0 281.720 4.105 20 5 CIBDRN CCC(CC)SCCc1ccc([N+](=O)[O-])cc1 ZINC000518989778 265282150 /nfs/dbraw/zinc/28/21/50/265282150.db2.gz KWBVEPVTGCUIMD-UHFFFAOYSA-N 0 0 253.367 4.059 20 5 CIBDRN Cc1cc(NC(=O)c2ccccc2[N+](=O)[O-])ccc1C1CC1 ZINC000357951840 266388694 /nfs/dbraw/zinc/38/86/94/266388694.db2.gz ZWTVZSADRCCOMD-UHFFFAOYSA-N 0 0 296.326 4.033 20 5 CIBDRN Cc1ccc(N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000021009337 327940338 /nfs/dbraw/zinc/94/03/38/327940338.db2.gz PJILPEFRYPWPEL-ZDUSSCGKSA-N 0 0 270.332 4.385 20 5 CIBDRN Cc1cscc1CNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000094883111 327959068 /nfs/dbraw/zinc/95/90/68/327959068.db2.gz YNPOPUANBCRVHV-UHFFFAOYSA-N 0 0 299.355 4.125 20 5 CIBDRN Cc1cscc1CNc1ccc([N+](=O)[O-])c2cccnc12 ZINC000094883162 327959096 /nfs/dbraw/zinc/95/90/96/327959096.db2.gz UOSHPVDUSHPQAU-UHFFFAOYSA-N 0 0 299.355 4.125 20 5 CIBDRN CCCN(Cc1csc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000534327286 328046018 /nfs/dbraw/zinc/04/60/18/328046018.db2.gz CVLYSRJTYNJEHC-UHFFFAOYSA-N 0 0 290.388 4.069 20 5 CIBDRN CCSc1ccccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000534386911 328050359 /nfs/dbraw/zinc/05/03/59/328050359.db2.gz DTLUKKYMSOCXJS-UHFFFAOYSA-N 0 0 289.356 4.286 20 5 CIBDRN CCc1ccc(CNc2ccc([N+](=O)[O-])c(C)c2)s1 ZINC000048336453 328053375 /nfs/dbraw/zinc/05/33/75/328053375.db2.gz KWTUVIMSCLCZRG-UHFFFAOYSA-N 0 0 276.361 4.139 20 5 CIBDRN Cc1ccc([C@@H](C)Nc2ncc(Cl)cc2[N+](=O)[O-])s1 ZINC000148492505 328112006 /nfs/dbraw/zinc/11/20/06/328112006.db2.gz FGITWJCPWUKMGZ-MRVPVSSYSA-N 0 0 297.767 4.186 20 5 CIBDRN CCC[C@H](CC)Nc1ccc2ncccc2c1[N+](=O)[O-] ZINC000050164840 328387676 /nfs/dbraw/zinc/38/76/76/328387676.db2.gz AVHNYMHZYLIOEP-NSHDSACASA-N 0 0 273.336 4.134 20 5 CIBDRN Cc1csc(CNc2cc(C)c([N+](=O)[O-])cc2F)c1 ZINC000379146252 328543355 /nfs/dbraw/zinc/54/33/55/328543355.db2.gz ULMMVDAAGXWBHO-UHFFFAOYSA-N 0 0 280.324 4.024 20 5 CIBDRN O=[N+]([O-])c1cnc(Nc2csc3ccccc23)s1 ZINC000409733620 327164345 /nfs/dbraw/zinc/16/43/45/327164345.db2.gz KKWOJWVLPBLAHN-UHFFFAOYSA-N 0 0 277.330 4.010 20 5 CIBDRN O=[N+]([O-])c1ccccc1CSCc1cc(F)ccc1F ZINC000560841429 327347452 /nfs/dbraw/zinc/34/74/52/327347452.db2.gz ICJLPLANYWVGHZ-UHFFFAOYSA-N 0 0 295.310 4.306 20 5 CIBDRN CSc1ccc(Oc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000561105596 327366687 /nfs/dbraw/zinc/36/66/87/327366687.db2.gz NZDIKEICQBFNME-UHFFFAOYSA-N 0 0 279.292 4.248 20 5 CIBDRN O=[N+]([O-])c1cccc(F)c1N1CCC[C@@H]1c1ccsc1 ZINC000561122671 327367868 /nfs/dbraw/zinc/36/78/68/327367868.db2.gz URDRBNFEGZSPIG-GFCCVEGCSA-N 0 0 292.335 4.137 20 5 CIBDRN C[C@@H](Nc1cccc2c1OCCC2)c1ccccc1[N+](=O)[O-] ZINC000532116122 328699664 /nfs/dbraw/zinc/69/96/64/328699664.db2.gz QMRMOUCBCNXFEC-GFCCVEGCSA-N 0 0 298.342 4.093 20 5 CIBDRN CC(C)c1ccc(NC(=O)c2csc([N+](=O)[O-])c2)cc1 ZINC000042566617 328769345 /nfs/dbraw/zinc/76/93/45/328769345.db2.gz ARYACKUFNWTHPK-UHFFFAOYSA-N 0 0 290.344 4.032 20 5 CIBDRN O=[N+]([O-])c1ccc(Oc2cccc(F)c2)c2ncccc12 ZINC000301079154 328826188 /nfs/dbraw/zinc/82/61/88/328826188.db2.gz NEGBYYGDBVWVEH-UHFFFAOYSA-N 0 0 284.246 4.074 20 5 CIBDRN Cc1cc(SCc2ccc(Cl)cc2)ncc1[N+](=O)[O-] ZINC000301431087 328827950 /nfs/dbraw/zinc/82/79/50/328827950.db2.gz 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CIBDRN CC[C@@H](Nc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000523087907 333307620 /nfs/dbraw/zinc/30/76/20/333307620.db2.gz IBSFTSXNKNEHRX-OAHLLOKOSA-N 0 0 292.285 4.436 20 5 CIBDRN Cc1ccc(CNc2cnc3ccccc3c2)cc1[N+](=O)[O-] ZINC000237815501 333381698 /nfs/dbraw/zinc/38/16/98/333381698.db2.gz FFLUDVYCOKPAJR-UHFFFAOYSA-N 0 0 293.326 4.064 20 5 CIBDRN Cc1cc(C)c(CNc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000037058559 333468763 /nfs/dbraw/zinc/46/87/63/333468763.db2.gz XKBMXELVMWPYLD-UHFFFAOYSA-N 0 0 270.332 4.132 20 5 CIBDRN C[C@@H]1CCCC[C@@H]1Nc1ccc2ncccc2c1[N+](=O)[O-] ZINC000037362213 333532245 /nfs/dbraw/zinc/53/22/45/333532245.db2.gz SXCFRLBPFGDWID-YPMHNXCESA-N 0 0 285.347 4.134 20 5 CIBDRN Cc1cccc(N[C@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000538509961 333601618 /nfs/dbraw/zinc/60/16/18/333601618.db2.gz FBMNECJPQBALSH-CYBMUJFWSA-N 0 0 270.332 4.385 20 5 CIBDRN Cc1c(NCCCCC(F)(F)F)cccc1[N+](=O)[O-] ZINC000128175661 333643801 /nfs/dbraw/zinc/64/38/01/333643801.db2.gz SQYVAYANQPPLFW-UHFFFAOYSA-N 0 0 276.258 4.048 20 5 CIBDRN CCC[C@@H](Nc1cc(C)ccn1)c1cccc([N+](=O)[O-])c1 ZINC000539611350 333681217 /nfs/dbraw/zinc/68/12/17/333681217.db2.gz GQIWNKXDEYHUNE-OAHLLOKOSA-N 0 0 285.347 4.252 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)Nc1cccc(F)c1 ZINC000540708640 333742819 /nfs/dbraw/zinc/74/28/19/333742819.db2.gz RCSIXBMKXVRNDS-LLVKDONJSA-N 0 0 274.295 4.215 20 5 CIBDRN Cc1ccc(N[C@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000540709894 333743031 /nfs/dbraw/zinc/74/30/31/333743031.db2.gz GPQHPBJRZJRNJH-CYBMUJFWSA-N 0 0 270.332 4.385 20 5 CIBDRN Cc1c(NC(=O)[C@@H](C)CCC(C)(C)C)cccc1[N+](=O)[O-] ZINC000541584117 333782349 /nfs/dbraw/zinc/78/23/49/333782349.db2.gz YUQRLZGNEDQOLJ-NSHDSACASA-N 0 0 292.379 4.304 20 5 CIBDRN CC(C)CC[C@@H](C)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000070186529 333801038 /nfs/dbraw/zinc/80/10/38/333801038.db2.gz HICMSCCYXUAXAV-GFCCVEGCSA-N 0 0 287.363 4.380 20 5 CIBDRN CC(C)(C)[C@@H]1CCN(c2ccc([N+](=O)[O-])c3cnccc32)C1 ZINC000542270330 333819705 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ZINC000547128036 334068298 /nfs/dbraw/zinc/06/82/98/334068298.db2.gz ZNRJKOPIPUBAJZ-JTQLQIEISA-N 0 0 289.335 4.103 20 5 CIBDRN Cc1cc(C)c([N+](=O)[O-])cc1NCc1ccc(F)c(F)c1 ZINC000134763199 334103092 /nfs/dbraw/zinc/10/30/92/334103092.db2.gz YUUHTBBHEKOAQD-UHFFFAOYSA-N 0 0 292.285 4.102 20 5 CIBDRN Cc1ccc(C)c(Cn2ccc3c2cccc3[N+](=O)[O-])c1 ZINC000134790593 334104384 /nfs/dbraw/zinc/10/43/84/334104384.db2.gz GMJMJBSOCXKANU-UHFFFAOYSA-N 0 0 280.327 4.215 20 5 CIBDRN O=[N+]([O-])c1ccccc1/C=C/CNc1cccc2cc[nH]c21 ZINC000548511643 334161651 /nfs/dbraw/zinc/16/16/51/334161651.db2.gz UGMUNJWORPDYLS-QPJJXVBHSA-N 0 0 293.326 4.201 20 5 CIBDRN Cc1nc(SCc2c(Cl)cccc2[N+](=O)[O-])oc1C ZINC000548611948 334163592 /nfs/dbraw/zinc/16/35/92/334163592.db2.gz ZWSAPNSINLHJQC-UHFFFAOYSA-N 0 0 298.751 4.145 20 5 CIBDRN O=[N+]([O-])c1ccc(OC[C@@H]2CCC(F)(F)C2)c(Cl)c1 ZINC000549615411 334199675 /nfs/dbraw/zinc/19/96/75/334199675.db2.gz AHNPBHIBTZVLAT-MRVPVSSYSA-N 0 0 291.681 4.062 20 5 CIBDRN O=[N+]([O-])c1ccc(OC[C@H]2CCC(F)(F)C2)c(Cl)c1 ZINC000549615412 334199696 /nfs/dbraw/zinc/19/96/96/334199696.db2.gz AHNPBHIBTZVLAT-QMMMGPOBSA-N 0 0 291.681 4.062 20 5 CIBDRN Cc1cccc(NCc2ccccc2[N+](=O)[O-])c1Cl ZINC000311439009 334217818 /nfs/dbraw/zinc/21/78/18/334217818.db2.gz TUWGPWQVTUJAFF-UHFFFAOYSA-N 0 0 276.723 4.169 20 5 CIBDRN Cc1c(CSCCCCCF)cccc1[N+](=O)[O-] ZINC000551004330 334236045 /nfs/dbraw/zinc/23/60/45/334236045.db2.gz ZSNKQKCGQHUIPC-UHFFFAOYSA-N 0 0 271.357 4.276 20 5 CIBDRN Cc1cc(C)cc(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000086167946 334304471 /nfs/dbraw/zinc/30/44/71/334304471.db2.gz WQWRIAKYUYXDCQ-UHFFFAOYSA-N 0 0 298.342 4.081 20 5 CIBDRN C[C@@H](c1cccc([N+](=O)[O-])c1)N1C[C@@H](C)c2ccccc21 ZINC000552344091 334319039 /nfs/dbraw/zinc/31/90/39/334319039.db2.gz XYXLHHALXGQMFM-OLZOCXBDSA-N 0 0 282.343 4.280 20 5 CIBDRN CC(=O)c1cc(N[C@@H](C)CCC(C)C)ccc1[N+](=O)[O-] ZINC000553330420 334378117 /nfs/dbraw/zinc/37/81/17/334378117.db2.gz AGNADNHCZHAUPB-NSHDSACASA-N 0 0 278.352 4.034 20 5 CIBDRN CC(C)Oc1ccc(Oc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000553441394 334385428 /nfs/dbraw/zinc/38/54/28/334385428.db2.gz VYJCZVNTSRNANC-UHFFFAOYSA-N 0 0 291.278 4.313 20 5 CIBDRN C[C@H]1CC[C@H](Nc2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000252967817 334403937 /nfs/dbraw/zinc/40/39/37/334403937.db2.gz UPSSVOCJGPLQGO-HAQNSBGRSA-N 0 0 285.347 4.134 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1NCc1csc(C(C)C)n1 ZINC000153339205 334588807 /nfs/dbraw/zinc/58/88/07/334588807.db2.gz JKCSTIMFAIIAJU-UHFFFAOYSA-N 0 0 291.376 4.095 20 5 CIBDRN CCCc1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1C ZINC000154050351 334686323 /nfs/dbraw/zinc/68/63/23/334686323.db2.gz PSCGHGLRDHRDOA-UHFFFAOYSA-N 0 0 298.342 4.108 20 5 CIBDRN CSCCCSc1ccc([N+](=O)[O-])cc1Cl ZINC000569167668 334858932 /nfs/dbraw/zinc/85/89/32/334858932.db2.gz BTBOQMZJSGQUSE-UHFFFAOYSA-N 0 0 277.798 4.093 20 5 CIBDRN Cc1c(COc2ccc(Cl)cc2F)cccc1[N+](=O)[O-] ZINC000380257784 335945529 /nfs/dbraw/zinc/94/55/29/335945529.db2.gz PAIVJFSZRFLURY-UHFFFAOYSA-N 0 0 295.697 4.275 20 5 CIBDRN O=[N+]([O-])c1ccc(-c2nc(C3CCCCCC3)no2)cc1 ZINC000581303766 336043082 /nfs/dbraw/zinc/04/30/82/336043082.db2.gz DQILHXKGSOGFOC-UHFFFAOYSA-N 0 0 287.319 4.083 20 5 CIBDRN Cc1cscc1N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000387271761 336190832 /nfs/dbraw/zinc/19/08/32/336190832.db2.gz TWOYXPIQWVUZCW-LLVKDONJSA-N 0 0 276.361 4.446 20 5 CIBDRN Cc1c(NCc2ccc3ncccc3c2)cccc1[N+](=O)[O-] ZINC000387290225 336191258 /nfs/dbraw/zinc/19/12/58/336191258.db2.gz OIDVUUOWPMTXQG-UHFFFAOYSA-N 0 0 293.326 4.064 20 5 CIBDRN COc1cccc2c1CC[C@@H]2Nc1c(C)cccc1[N+](=O)[O-] ZINC000301666673 533869124 /nfs/dbraw/zinc/86/91/24/533869124.db2.gz WYODZUFUIAXWRP-AWEZNQCLSA-N 0 0 298.342 4.011 20 5 CIBDRN CC1(C)CCC(Sc2ccncc2[N+](=O)[O-])CC1 ZINC000340845362 520305763 /nfs/dbraw/zinc/30/57/63/520305763.db2.gz DLADCWISPFTKNC-UHFFFAOYSA-N 0 0 266.366 4.051 20 5 CIBDRN CCC(=O)c1ccc(Oc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000042096439 521250777 /nfs/dbraw/zinc/25/07/77/521250777.db2.gz SKLKPHXFRICKSZ-UHFFFAOYSA-N 0 0 289.262 4.119 20 5 CIBDRN Cc1cnc(N[C@@H](C)c2cccc(C)c2C)c([N+](=O)[O-])c1 ZINC000301461036 534590475 /nfs/dbraw/zinc/59/04/75/534590475.db2.gz UMDZNTHDBRQPEE-ZDUSSCGKSA-N 0 0 285.347 4.088 20 5 CIBDRN CC[C@H](Nc1cc(C)c([N+](=O)[O-])cc1F)c1ccncc1 ZINC000292814302 522765472 /nfs/dbraw/zinc/76/54/72/522765472.db2.gz ZGCKUJLHQALMTE-ZDUSSCGKSA-N 0 0 289.310 4.001 20 5 CIBDRN CC[C@@H](Nc1ccc([N+](=O)[O-])cc1F)c1cccs1 ZINC000049531341 522959102 /nfs/dbraw/zinc/95/91/02/522959102.db2.gz OXUMEIBAPIFOKQ-LLVKDONJSA-N 0 0 280.324 4.359 20 5 CIBDRN Cc1ccc(OCc2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000060706433 525446242 /nfs/dbraw/zinc/44/62/42/525446242.db2.gz JZMXZVNBQBRBJO-UHFFFAOYSA-N 0 0 277.707 4.136 20 5 CIBDRN Cc1cc([C@@H](C)Nc2ncc([N+](=O)[O-])cc2Cl)c(C)o1 ZINC000227650494 525478117 /nfs/dbraw/zinc/47/81/17/525478117.db2.gz OZIKAIVYEJFBBR-MRVPVSSYSA-N 0 0 295.726 4.026 20 5 CIBDRN C[C@H](Nc1ccc(Cl)cc1[N+](=O)[O-])c1ccsc1 ZINC000050341293 525651658 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527407844 /nfs/dbraw/zinc/40/78/44/527407844.db2.gz LYUHMVLPCYPIHA-UHFFFAOYSA-N 0 0 273.672 4.241 20 5 CIBDRN O=[N+]([O-])c1cnccc1SCc1ccccc1C1CC1 ZINC000340860639 527414861 /nfs/dbraw/zinc/41/48/61/527414861.db2.gz CBHZXSUQOFPFED-UHFFFAOYSA-N 0 0 286.356 4.160 20 5 CIBDRN C[C@H](Oc1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000096956362 185140382 /nfs/dbraw/zinc/14/03/82/185140382.db2.gz BRCURJYYOIYCCE-VIFPVBQESA-N 0 0 279.242 4.013 20 5 CIBDRN COc1ccccc1Sc1c(F)cc([N+](=O)[O-])cc1F ZINC000301811219 532962139 /nfs/dbraw/zinc/96/21/39/532962139.db2.gz XXKJFFQKHIQSBP-UHFFFAOYSA-N 0 0 297.282 4.033 20 5 CIBDRN CC[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1 ZINC000005476442 170103060 /nfs/dbraw/zinc/10/30/60/170103060.db2.gz LWUAPNOJRCPEML-HNNXBMFYSA-N 0 0 298.342 4.036 20 5 CIBDRN O=[N+]([O-])c1cccc(CNc2cccc(C(F)(F)F)c2)c1 ZINC000020042342 170976196 /nfs/dbraw/zinc/97/61/96/170976196.db2.gz LZPXTAANTVAQOS-UHFFFAOYSA-N 0 0 296.248 4.226 20 5 CIBDRN Cc1ccc(C)c(N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000021800637 171325971 /nfs/dbraw/zinc/32/59/71/171325971.db2.gz DMOYQTCVYYBVQV-ZDUSSCGKSA-N 0 0 270.332 4.385 20 5 CIBDRN CC(C)[C@@H](Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000035019705 171938429 /nfs/dbraw/zinc/93/84/29/171938429.db2.gz RDCNPUWOVIRVRU-MRXNPFEDSA-N 0 0 270.332 4.404 20 5 CIBDRN O=[N+]([O-])c1ccc(NCc2ccc3ccccc3c2)cc1 ZINC000035223886 172068268 /nfs/dbraw/zinc/06/82/68/172068268.db2.gz IQMXCLMYFARDPR-UHFFFAOYSA-N 0 0 278.311 4.360 20 5 CIBDRN O=[N+]([O-])c1cc(NCc2ccc(F)c(F)c2)ccc1Cl ZINC000035224124 172068952 /nfs/dbraw/zinc/06/89/52/172068952.db2.gz YEISVZSMMPNPRB-UHFFFAOYSA-N 0 0 298.676 4.139 20 5 CIBDRN Cc1cc(NCc2ccccc2Cl)ccc1[N+](=O)[O-] ZINC000035277317 172097290 /nfs/dbraw/zinc/09/72/90/172097290.db2.gz AAMQZQPYCNARLR-UHFFFAOYSA-N 0 0 276.723 4.169 20 5 CIBDRN CCCc1ccc(NCc2csc([N+](=O)[O-])c2)cc1 ZINC000037562610 173272747 /nfs/dbraw/zinc/27/27/47/173272747.db2.gz WSOMRNPXXSEVQN-UHFFFAOYSA-N 0 0 276.361 4.221 20 5 CIBDRN Cc1ccc(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1C ZINC000071817810 176270271 /nfs/dbraw/zinc/27/02/71/176270271.db2.gz PIXXYDNANQZXCX-UHFFFAOYSA-N 0 0 295.294 4.189 20 5 CIBDRN Cc1ccc(-c2csc(-c3ccoc3)n2)cc1[N+](=O)[O-] ZINC000078527077 177350307 /nfs/dbraw/zinc/35/03/07/177350307.db2.gz WRVKOSRJFQPCFA-UHFFFAOYSA-N 0 0 286.312 4.287 20 5 CIBDRN O=[N+]([O-])c1ccc(Cl)cc1Oc1nc2ccccc2o1 ZINC000301132694 227459146 /nfs/dbraw/zinc/45/91/46/227459146.db2.gz XEMBNICNJNKWGU-UHFFFAOYSA-N 0 0 290.662 4.182 20 5 CIBDRN Cc1cc([N+](=O)[O-])cnc1N[C@@H](C)c1cc2ccccc2o1 ZINC000301211090 227475798 /nfs/dbraw/zinc/47/57/98/227475798.db2.gz WQKHYCNYYCNOJJ-NSHDSACASA-N 0 0 297.314 4.218 20 5 CIBDRN O=[N+]([O-])c1ccc(NCCC[C@@H]2CCCCO2)c(Cl)c1 ZINC000302217555 227823860 /nfs/dbraw/zinc/82/38/60/227823860.db2.gz KGAPMAAYLWKWLP-LBPRGKRZSA-N 0 0 298.770 4.009 20 5 CIBDRN Cc1c([C@@H](C)Nc2cc(C3CC3)ccn2)cccc1[N+](=O)[O-] ZINC000353566797 228122282 /nfs/dbraw/zinc/12/22/82/228122282.db2.gz YMUBJMXUQBQMHA-GFCCVEGCSA-N 0 0 297.358 4.349 20 5 CIBDRN C[C@H]1CCC[C@H](N(C)c2ccc([N+](=O)[O-])c3cnccc32)C1 ZINC000519966657 260034089 /nfs/dbraw/zinc/03/40/89/260034089.db2.gz XDVIDGYRTRKSIC-STQMWFEESA-N 0 0 299.374 4.158 20 5 CIBDRN C[C@@H]1CCC[C@@H](N(C)c2ccc([N+](=O)[O-])c3cnccc32)C1 ZINC000519966654 260034144 /nfs/dbraw/zinc/03/41/44/260034144.db2.gz XDVIDGYRTRKSIC-CHWSQXEVSA-N 0 0 299.374 4.158 20 5 CIBDRN Cc1ccc(N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000447584289 260065927 /nfs/dbraw/zinc/06/59/27/260065927.db2.gz FLFOJXOWAKGECB-KRWDZBQOSA-N 0 0 282.343 4.393 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)SCCCF ZINC000180713786 260109412 /nfs/dbraw/zinc/10/94/12/260109412.db2.gz RWCNLBZZVKEZKR-JTQLQIEISA-N 0 0 257.330 4.057 20 5 CIBDRN Cc1cnc(N[C@@H](C)c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000090692189 260261146 /nfs/dbraw/zinc/26/11/46/260261146.db2.gz QTBGRAPJKXJREJ-JTQLQIEISA-N 0 0 291.738 4.125 20 5 CIBDRN Cc1cc(N[C@H](C)c2cccc(Cl)c2)ncc1[N+](=O)[O-] ZINC000092026852 260267116 /nfs/dbraw/zinc/26/71/16/260267116.db2.gz PEOFPHIHBRVUCR-SNVBAGLBSA-N 0 0 291.738 4.125 20 5 CIBDRN Cc1cc(N[C@H](C)c2ccccc2Cl)ncc1[N+](=O)[O-] ZINC000092026974 260267269 /nfs/dbraw/zinc/26/72/69/260267269.db2.gz HITYTVPSMCLEEN-SNVBAGLBSA-N 0 0 291.738 4.125 20 5 CIBDRN Cc1cc([N+](=O)[O-])cnc1N[C@H]1CCC[C@@H]1c1ccccc1 ZINC000518391653 260396895 /nfs/dbraw/zinc/39/68/95/260396895.db2.gz JGOSTKLZSGOKFI-CVEARBPZSA-N 0 0 297.358 4.046 20 5 CIBDRN O=[N+]([O-])c1cccc(F)c1OCCSC1CCCCC1 ZINC000410318060 260484751 /nfs/dbraw/zinc/48/47/51/260484751.db2.gz NNGSOZYFICYXNI-UHFFFAOYSA-N 0 0 299.367 4.179 20 5 CIBDRN Cc1cc([C@@H](C)Nc2ccc([N+](=O)[O-])c(C)n2)c(C)s1 ZINC000161516955 261069494 /nfs/dbraw/zinc/06/94/94/261069494.db2.gz PKWGJLUWWYKHQR-SECBINFHSA-N 0 0 291.376 4.150 20 5 CIBDRN CCc1ccc([C@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000155819793 261108395 /nfs/dbraw/zinc/10/83/95/261108395.db2.gz OOBZINMSLNGLRB-NEPJUHHUSA-N 0 0 288.347 4.162 20 5 CIBDRN Cc1c(CNc2cc(F)cc(Cl)c2)cccc1[N+](=O)[O-] ZINC000217529442 261114036 /nfs/dbraw/zinc/11/40/36/261114036.db2.gz NHZKYAQBLMRXJE-UHFFFAOYSA-N 0 0 294.713 4.308 20 5 CIBDRN O=[N+]([O-])c1c(F)cccc1NCc1ccc(F)c(Cl)c1 ZINC000053158775 261318045 /nfs/dbraw/zinc/31/80/45/261318045.db2.gz STXREVSVNWFVFN-UHFFFAOYSA-N 0 0 298.676 4.139 20 5 CIBDRN Cc1cnc(NCc2cccc3ccccc32)c([N+](=O)[O-])c1 ZINC000301375316 261334821 /nfs/dbraw/zinc/33/48/21/261334821.db2.gz VMWZNKIUZSMBDT-UHFFFAOYSA-N 0 0 293.326 4.064 20 5 CIBDRN CCc1cccc(N[C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000020526102 262245007 /nfs/dbraw/zinc/24/50/07/262245007.db2.gz RUWUXECMUMTVNH-LBPRGKRZSA-N 0 0 270.332 4.330 20 5 CIBDRN CCc1ccc(N[C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000020526087 262245097 /nfs/dbraw/zinc/24/50/97/262245097.db2.gz TYCHMXHTKUEXCS-GFCCVEGCSA-N 0 0 270.332 4.330 20 5 CIBDRN C[C@H](Nc1ccc2c(c1)CCC2)c1ccccc1[N+](=O)[O-] ZINC000020526008 262245300 /nfs/dbraw/zinc/24/53/00/262245300.db2.gz KKJCUHOGJNDFRD-LBPRGKRZSA-N 0 0 282.343 4.257 20 5 CIBDRN O=[N+]([O-])c1c(F)cccc1N[C@H]1CCCc2sccc21 ZINC000061364266 262396452 /nfs/dbraw/zinc/39/64/52/262396452.db2.gz KHVCGDFQUDMEAH-NSHDSACASA-N 0 0 292.335 4.285 20 5 CIBDRN O=[N+]([O-])c1ccc(N[C@H]2C[C@H](c3ccccc3F)C2)cc1 ZINC000435590747 262745587 /nfs/dbraw/zinc/74/55/87/262745587.db2.gz YMYHJYWRUYJNGT-AULYBMBSSA-N 0 0 286.306 4.092 20 5 CIBDRN CC(F)(F)c1cccc(NCc2ccccc2[N+](=O)[O-])c1 ZINC000187587729 263262886 /nfs/dbraw/zinc/26/28/86/263262886.db2.gz BDBLULFJQWNHAU-UHFFFAOYSA-N 0 0 292.285 4.319 20 5 CIBDRN C[C@@H]1CCC[C@H](c2noc(-c3ccc([N+](=O)[O-])s3)n2)C1 ZINC000356222479 266075311 /nfs/dbraw/zinc/07/53/11/266075311.db2.gz PRCJSWSLBJRDLR-BDAKNGLRSA-N 0 0 293.348 4.000 20 5 CIBDRN Cc1cc([N+](=O)[O-])ccc1-c1noc([C@@H](C)CC(C)C)n1 ZINC000575051059 327655878 /nfs/dbraw/zinc/65/58/78/327655878.db2.gz FULGIINACZBOSB-NSHDSACASA-N 0 0 289.335 4.103 20 5 CIBDRN Cc1c(CNc2ccc3ccccc3n2)cccc1[N+](=O)[O-] ZINC000302657987 327721436 /nfs/dbraw/zinc/72/14/36/327721436.db2.gz HUMMOHVWKMLAJR-UHFFFAOYSA-N 0 0 293.326 4.064 20 5 CIBDRN C/C=C/c1ccc(NC(=O)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000580230776 327745334 /nfs/dbraw/zinc/74/53/34/327745334.db2.gz WITVFOFOELDKME-HWKANZROSA-N 0 0 296.326 4.189 20 5 CIBDRN CC(C)(C)Oc1cc(N[C@H]2CC[C@@H](F)C2)ccc1[N+](=O)[O-] ZINC000571196936 328091733 /nfs/dbraw/zinc/09/17/33/328091733.db2.gz RNOULSMIXMMOPN-MNOVXSKESA-N 0 0 296.342 4.075 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CCCC(C)(C)C1 ZINC000534461902 328130279 /nfs/dbraw/zinc/13/02/79/328130279.db2.gz MYZMVXOTTSUGMH-GFCCVEGCSA-N 0 0 290.363 4.058 20 5 CIBDRN Cc1cc(C)cc([C@@H](C)Nc2ccccc2[N+](=O)[O-])c1 ZINC000113412381 328616004 /nfs/dbraw/zinc/61/60/04/328616004.db2.gz JDSHUTBFWPFOEW-CYBMUJFWSA-N 0 0 270.332 4.385 20 5 CIBDRN C[C@@H](Sc1ccc([N+](=O)[O-])cn1)c1ccccc1Cl ZINC000049057552 328329870 /nfs/dbraw/zinc/32/98/70/328329870.db2.gz STJYHWUCKIHTNF-SECBINFHSA-N 0 0 294.763 4.497 20 5 CIBDRN Cc1cccc(NCc2c(Cl)cccc2[N+](=O)[O-])c1C ZINC000111333266 328347223 /nfs/dbraw/zinc/34/72/23/328347223.db2.gz RMRWCYPXSMXOTO-UHFFFAOYSA-N 0 0 290.750 4.477 20 5 CIBDRN CCC[C@@H](CC)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000050165018 328387957 /nfs/dbraw/zinc/38/79/57/328387957.db2.gz WONURLXGKUAOHB-LLVKDONJSA-N 0 0 273.336 4.134 20 5 CIBDRN O=[N+]([O-])c1cc(Cl)ccc1CSc1ccccc1O ZINC000050444899 328439777 /nfs/dbraw/zinc/43/97/77/328439777.db2.gz IUJAKOCSWVTASA-UHFFFAOYSA-N 0 0 295.747 4.246 20 5 CIBDRN CC[C@H](Cc1ccccc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000112466152 328439838 /nfs/dbraw/zinc/43/98/38/328439838.db2.gz LGRSBNRZRANGRK-CQSZACIVSA-N 0 0 270.332 4.028 20 5 CIBDRN Cc1ccc([C@H](C)Nc2cccc(F)c2[N+](=O)[O-])s1 ZINC000048805781 328456946 /nfs/dbraw/zinc/45/69/46/328456946.db2.gz PVFBUBNWVONGJJ-VIFPVBQESA-N 0 0 280.324 4.277 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)Nc1cccc2c1CCO2 ZINC000530529535 326851629 /nfs/dbraw/zinc/85/16/29/326851629.db2.gz FBGSAPXFSLMFOS-LBPRGKRZSA-N 0 0 298.342 4.011 20 5 CIBDRN O=[N+]([O-])c1ccc(NCc2cc(F)ccc2F)c(Cl)c1 ZINC000036970956 326874562 /nfs/dbraw/zinc/87/45/62/326874562.db2.gz LXTFILITDFCHRH-UHFFFAOYSA-N 0 0 298.676 4.139 20 5 CIBDRN C[C@@H](Nc1ccnc2c1cccc2[N+](=O)[O-])c1ccccc1 ZINC000317459280 327018758 /nfs/dbraw/zinc/01/87/58/327018758.db2.gz OPAUKUTZKHXZLU-GFCCVEGCSA-N 0 0 293.326 4.316 20 5 CIBDRN Cc1cnccc1SCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000558873396 327129000 /nfs/dbraw/zinc/12/90/00/327129000.db2.gz XCEMTQUVKHFYRJ-UHFFFAOYSA-N 0 0 294.763 4.244 20 5 CIBDRN Cc1cccc(N2CCC[C@@H]2c2ccsc2)c1[N+](=O)[O-] ZINC000558888061 327129621 /nfs/dbraw/zinc/12/96/21/327129621.db2.gz ULFFOMJWBCTVGC-CYBMUJFWSA-N 0 0 288.372 4.306 20 5 CIBDRN Cc1cccc(OCc2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000569523678 327191744 /nfs/dbraw/zinc/19/17/44/327191744.db2.gz KXXNMQQDATYVPD-UHFFFAOYSA-N 0 0 277.707 4.136 20 5 CIBDRN CC(=O)c1cc(N[C@@H](C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000561213840 327376232 /nfs/dbraw/zinc/37/62/32/327376232.db2.gz MVBADIKOMHCVRO-NSHDSACASA-N 0 0 290.363 4.178 20 5 CIBDRN O=[N+]([O-])c1cccc(F)c1N1CCC[C@H]1c1cccs1 ZINC000569637290 327455577 /nfs/dbraw/zinc/45/55/77/327455577.db2.gz IOJBUEDWYAIRNE-NSHDSACASA-N 0 0 292.335 4.137 20 5 CIBDRN Cc1cc(C)cc([C@H](C)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000113412391 328615936 /nfs/dbraw/zinc/61/59/36/328615936.db2.gz LGPIIZLVKSYYIC-ZDUSSCGKSA-N 0 0 270.332 4.385 20 5 CIBDRN Cc1cccc(NC(=O)Nc2cccc([N+](=O)[O-])c2C)c1C ZINC000113526970 328621845 /nfs/dbraw/zinc/62/18/45/328621845.db2.gz DTRXMIZOHNPJOO-UHFFFAOYSA-N 0 0 299.330 4.164 20 5 CIBDRN Cc1cc(N[C@H](c2ccccc2)C2CC2)ccc1[N+](=O)[O-] ZINC000042249720 328762986 /nfs/dbraw/zinc/76/29/86/328762986.db2.gz GTPTYGAVFAXONG-QGZVFWFLSA-N 0 0 282.343 4.466 20 5 CIBDRN CO[C@H](C)c1cccc(Nc2ccc([N+](=O)[O-])cc2F)c1 ZINC000301163795 328827051 /nfs/dbraw/zinc/82/70/51/328827051.db2.gz TWBYVOBAMKOZQG-SNVBAGLBSA-N 0 0 290.294 4.185 20 5 CIBDRN O=[N+]([O-])c1ccc(N[C@@H]2CCCC[C@H]2c2ccccc2)cn1 ZINC000582868927 329278606 /nfs/dbraw/zinc/27/86/06/329278606.db2.gz NRSOPECTVWTXNV-JKSUJKDBSA-N 0 0 297.358 4.128 20 5 CIBDRN Cc1ccccc1[C@H](Nc1ccc([N+](=O)[O-])nc1)C(C)C ZINC000582988528 329294184 /nfs/dbraw/zinc/29/41/84/329294184.db2.gz GMVOVZFCYBWGRK-MRXNPFEDSA-N 0 0 285.347 4.107 20 5 CIBDRN O=[N+]([O-])c1cccc(SCc2cnc3ccccc3c2)c1 ZINC000509090566 332858900 /nfs/dbraw/zinc/85/89/00/332858900.db2.gz RIPBAEYFYSKVDF-UHFFFAOYSA-N 0 0 296.351 4.435 20 5 CIBDRN Cc1cn(CC2CCC(c3ccccc3)CC2)nc1[N+](=O)[O-] ZINC000509819985 332882721 /nfs/dbraw/zinc/88/27/21/332882721.db2.gz LXCXDINXRHNONX-UHFFFAOYSA-N 0 0 299.374 4.074 20 5 CIBDRN C[C@@H](Sc1ccccc1O)c1cccc([N+](=O)[O-])c1 ZINC000161754411 329954410 /nfs/dbraw/zinc/95/44/10/329954410.db2.gz LNYSCHUWQLUVSE-SNVBAGLBSA-N 0 0 275.329 4.154 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)CC1CCCC1 ZINC000510124723 332893581 /nfs/dbraw/zinc/89/35/81/332893581.db2.gz MGUYDVWXZSUVOT-LBPRGKRZSA-N 0 0 290.363 4.058 20 5 CIBDRN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C[C@@H](C)C(C)(C)C ZINC000086613895 330370475 /nfs/dbraw/zinc/37/04/75/330370475.db2.gz LAWVEBVBCAIXMP-LLVKDONJSA-N 0 0 292.379 4.222 20 5 CIBDRN C[C@@H]([NH2+]Cc1cc2ccccc2o1)c1cccc([N+](=O)[O-])c1 ZINC000119708535 330378929 /nfs/dbraw/zinc/37/89/29/330378929.db2.gz XTQDWTPZPWNAKH-GFCCVEGCSA-N 0 0 296.326 4.192 20 5 CIBDRN Cc1c([C@H](C)Nc2ccc(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000537445333 330437062 /nfs/dbraw/zinc/43/70/62/330437062.db2.gz AMKBHWAINBAXJC-JTQLQIEISA-N 0 0 292.285 4.355 20 5 CIBDRN Cc1c(CSc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000515288776 330474044 /nfs/dbraw/zinc/47/40/44/330474044.db2.gz AHWVOBLCBQHGPX-UHFFFAOYSA-N 0 0 277.320 4.335 20 5 CIBDRN Cc1ccc(N[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cn1 ZINC000433229891 330620631 /nfs/dbraw/zinc/62/06/31/330620631.db2.gz SSHXZFJAOCDNEJ-MRXNPFEDSA-N 0 0 297.358 4.133 20 5 CIBDRN O=[N+]([O-])c1cccc(F)c1NCc1ccc(Cl)s1 ZINC000156396215 330731665 /nfs/dbraw/zinc/73/16/65/330731665.db2.gz KQAGWMHYHYTBMI-UHFFFAOYSA-N 0 0 286.715 4.061 20 5 CIBDRN O=[N+]([O-])c1cccc(CNc2cc(Cl)cc(F)c2F)c1 ZINC000442106742 330774170 /nfs/dbraw/zinc/77/41/70/330774170.db2.gz CLVZOAQHAAUBNT-UHFFFAOYSA-N 0 0 298.676 4.139 20 5 CIBDRN Cc1c(CNc2ccc3ccoc3c2)cccc1[N+](=O)[O-] ZINC000442859511 330787780 /nfs/dbraw/zinc/78/77/80/330787780.db2.gz AINYBTAETYLVEW-UHFFFAOYSA-N 0 0 282.299 4.262 20 5 CIBDRN CC(C)c1cnc(N[C@@H](C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000450562283 330797724 /nfs/dbraw/zinc/79/77/24/330797724.db2.gz QXJPSCKOENLIJK-JTQLQIEISA-N 0 0 291.376 4.348 20 5 CIBDRN CC(C)=CCSc1ccc([N+](=O)[O-])c2cccnc12 ZINC000447688545 330874183 /nfs/dbraw/zinc/87/41/83/330874183.db2.gz LYNYPZAUNGPSBT-UHFFFAOYSA-N 0 0 274.345 4.201 20 5 CIBDRN Cc1cc(N[C@H](C)CCCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000163397927 331032560 /nfs/dbraw/zinc/03/25/60/331032560.db2.gz GGHQSNBDQKVZEY-SNVBAGLBSA-N 0 0 290.285 4.436 20 5 CIBDRN Cc1c(-c2noc([C@@H]3CC34CCCC4)n2)cccc1[N+](=O)[O-] ZINC000453247830 331107052 /nfs/dbraw/zinc/10/70/52/331107052.db2.gz FGDPORDMDNYPNW-LBPRGKRZSA-N 0 0 299.330 4.001 20 5 CIBDRN CCC[C@@H](Nc1ncc([N+](=O)[O-])s1)c1ccccc1 ZINC000195506236 331175688 /nfs/dbraw/zinc/17/56/88/331175688.db2.gz JHTTZYRGQAKJTM-LLVKDONJSA-N 0 0 277.349 4.005 20 5 CIBDRN CCC[C@@H](Nc1ccc(C)nc1)c1cccc([N+](=O)[O-])c1 ZINC000164550196 331251895 /nfs/dbraw/zinc/25/18/95/331251895.db2.gz GOQKKGPRLFVSRR-MRXNPFEDSA-N 0 0 285.347 4.252 20 5 CIBDRN Cc1cc(OCc2ccc(C(F)F)cc2)ccc1[N+](=O)[O-] ZINC000461407379 331312935 /nfs/dbraw/zinc/31/29/35/331312935.db2.gz MWYPWLWMYCTJNN-UHFFFAOYSA-N 0 0 293.269 4.420 20 5 CIBDRN Cc1cc(N2Cc3ccccc3[C@@H]2C)c(F)cc1[N+](=O)[O-] ZINC000461933922 331315627 /nfs/dbraw/zinc/31/56/27/331315627.db2.gz HXCCTJWTZSZJAT-NSHDSACASA-N 0 0 286.306 4.124 20 5 CIBDRN Cc1ccc(Cl)cc1Oc1ccccc1[N+](=O)[O-] ZINC000462945656 331335730 /nfs/dbraw/zinc/33/57/30/331335730.db2.gz SEIYGUOOKDHYEM-UHFFFAOYSA-N 0 0 263.680 4.349 20 5 CIBDRN C[C@H](CNc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000463028407 331337566 /nfs/dbraw/zinc/33/75/66/331337566.db2.gz KRSNAZMHSOXVCK-SNVBAGLBSA-N 0 0 292.285 4.089 20 5 CIBDRN C[C@@H](Sc1nc2ccccc2[nH]1)c1ccccc1[N+](=O)[O-] ZINC000463031709 331337839 /nfs/dbraw/zinc/33/78/39/331337839.db2.gz ZPCNBIHFOBZQBS-SNVBAGLBSA-N 0 0 299.355 4.324 20 5 CIBDRN Cc1cnc(Oc2cc(C)c(Cl)c(C)c2)c([N+](=O)[O-])c1 ZINC000463054275 331338874 /nfs/dbraw/zinc/33/88/74/331338874.db2.gz QADMWMRQCPQSEW-UHFFFAOYSA-N 0 0 292.722 4.361 20 5 CIBDRN Cc1cnc(N[C@H](c2ccccc2)C2CCC2)c([N+](=O)[O-])c1 ZINC000463057529 331338938 /nfs/dbraw/zinc/33/89/38/331338938.db2.gz PTXCXHZJKFBHMI-MRXNPFEDSA-N 0 0 297.358 4.252 20 5 CIBDRN CCC[C@]1(C)CCCN(c2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000463068326 331339163 /nfs/dbraw/zinc/33/91/63/331339163.db2.gz KMVUHIXUQSXHDF-MRXNPFEDSA-N 0 0 292.379 4.010 20 5 CIBDRN CCC[C@]1(C)CCCN(c2ncc([N+](=O)[O-])cc2Cl)C1 ZINC000463069187 331339244 /nfs/dbraw/zinc/33/92/44/331339244.db2.gz OUXSWGXXDQBCCM-CQSZACIVSA-N 0 0 297.786 4.050 20 5 CIBDRN CC(C)[C@H](C)S[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000463226473 331341712 /nfs/dbraw/zinc/34/17/12/331341712.db2.gz ZUVILCGIUVKTEE-WDEREUQCSA-N 0 0 253.367 4.434 20 5 CIBDRN CC(C)[C@@H](C)SCCCOc1ccc([N+](=O)[O-])cc1 ZINC000463220732 331342692 /nfs/dbraw/zinc/34/26/92/331342692.db2.gz DZWVFZNVFOTGCC-GFCCVEGCSA-N 0 0 283.393 4.141 20 5 CIBDRN Cc1c(NC(=O)C2(CC(C)C)CCC2)cccc1[N+](=O)[O-] ZINC000465448593 331383749 /nfs/dbraw/zinc/38/37/49/331383749.db2.gz NNOIECGKDZIFCG-UHFFFAOYSA-N 0 0 290.363 4.058 20 5 CIBDRN Cc1ccc(Oc2cnc3ccccc3c2)c([N+](=O)[O-])c1 ZINC000466441955 331397267 /nfs/dbraw/zinc/39/72/67/331397267.db2.gz OUHOYWOYNZITMT-UHFFFAOYSA-N 0 0 280.283 4.244 20 5 CIBDRN CCCC1(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)CCC1 ZINC000469358067 331450126 /nfs/dbraw/zinc/45/01/26/331450126.db2.gz LAQSADSWJOHNEM-UHFFFAOYSA-N 0 0 290.363 4.121 20 5 CIBDRN Cc1ccc([C@H](C)Nc2cc(C)c([N+](=O)[O-])cn2)c(C)c1 ZINC000470859740 331492724 /nfs/dbraw/zinc/49/27/24/331492724.db2.gz OUZOHCQVGMLRGD-ZDUSSCGKSA-N 0 0 285.347 4.088 20 5 CIBDRN Cc1ccccc1[C@@H](Nc1cc(C)c([N+](=O)[O-])cn1)C1CC1 ZINC000470871508 331493569 /nfs/dbraw/zinc/49/35/69/331493569.db2.gz FHHIBGDIWKGITO-KRWDZBQOSA-N 0 0 297.358 4.170 20 5 CIBDRN Cc1ccc(Cl)cc1Oc1ccc([N+](=O)[O-])c(C)n1 ZINC000471046464 331499745 /nfs/dbraw/zinc/49/97/45/331499745.db2.gz FWOHYWJFRRYQPL-UHFFFAOYSA-N 0 0 278.695 4.052 20 5 CIBDRN CC[C@H]1CCCC[C@H]1C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000474076769 331568174 /nfs/dbraw/zinc/56/81/74/331568174.db2.gz CXVDSSHYIHNXRS-QWHCGFSZSA-N 0 0 290.363 4.058 20 5 CIBDRN O=[N+]([O-])c1cccc(-c2nc(C3CCCC3)cs2)c1 ZINC000477224941 331679396 /nfs/dbraw/zinc/67/93/96/331679396.db2.gz DSISROYOBONMPZ-UHFFFAOYSA-N 0 0 274.345 4.376 20 5 CIBDRN O=C(Nc1cccc([N+](=O)[O-])c1)c1ccc(C2CCC2)cc1 ZINC000477832644 331691142 /nfs/dbraw/zinc/69/11/42/331691142.db2.gz RCIUGWJUPCRUEP-UHFFFAOYSA-N 0 0 296.326 4.115 20 5 CIBDRN Cc1ccc([N+](=O)[O-])c(Oc2ccc(Cl)c(C)c2)n1 ZINC000481701776 331812559 /nfs/dbraw/zinc/81/25/59/331812559.db2.gz FVVPPCFAPJCLCM-UHFFFAOYSA-N 0 0 278.695 4.052 20 5 CIBDRN Cc1nc2ccc(Nc3ccc([N+](=O)[O-])cc3)cc2s1 ZINC000483971899 331890325 /nfs/dbraw/zinc/89/03/25/331890325.db2.gz AQGIPGYCLPLJQI-UHFFFAOYSA-N 0 0 285.328 4.257 20 5 CIBDRN COc1cc(CSc2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000484541980 331901836 /nfs/dbraw/zinc/90/18/36/331901836.db2.gz JHPAGUARYILRSM-UHFFFAOYSA-N 0 0 293.319 4.035 20 5 CIBDRN COc1cc(CSCc2ccccc2)ccc1[N+](=O)[O-] ZINC000484695903 331904357 /nfs/dbraw/zinc/90/43/57/331904357.db2.gz WGBSBWXURULRPK-UHFFFAOYSA-N 0 0 289.356 4.037 20 5 CIBDRN O=[N+]([O-])c1ccc(NC[C@@H]2CCC(F)(F)C2)c(Cl)c1 ZINC000485418039 331913800 /nfs/dbraw/zinc/91/38/00/331913800.db2.gz UBRZALITNCYRTM-MRVPVSSYSA-N 0 0 290.697 4.096 20 5 CIBDRN C[C@@H](c1cc(F)ccc1F)N(C)c1ccccc1[N+](=O)[O-] ZINC000303535687 332936304 /nfs/dbraw/zinc/93/63/04/332936304.db2.gz HCWGXTMXIPODTJ-JTQLQIEISA-N 0 0 292.285 4.070 20 5 CIBDRN O=[N+]([O-])c1cccc(Cl)c1COc1cccc(F)c1F ZINC000488719342 332022626 /nfs/dbraw/zinc/02/26/26/332022626.db2.gz HYOPQCBDXAZZKM-UHFFFAOYSA-N 0 0 299.660 4.105 20 5 CIBDRN CCOc1cc(CSc2ccoc2C)ccc1[N+](=O)[O-] ZINC000491984733 332378159 /nfs/dbraw/zinc/37/81/59/332378159.db2.gz ZXDNTUKTWDAWEQ-UHFFFAOYSA-N 0 0 293.344 4.187 20 5 CIBDRN CCOc1cc(CSc2ccccc2)ccc1[N+](=O)[O-] ZINC000492024965 332379568 /nfs/dbraw/zinc/37/95/68/332379568.db2.gz SCBTZVGPORHTAS-UHFFFAOYSA-N 0 0 289.356 4.286 20 5 CIBDRN CCOc1cc(CSc2cccs2)ccc1[N+](=O)[O-] ZINC000492194019 332386604 /nfs/dbraw/zinc/38/66/04/332386604.db2.gz PVDAEOIMANDRKV-UHFFFAOYSA-N 0 0 295.385 4.347 20 5 CIBDRN O=[N+]([O-])c1cc(Cl)ccc1COc1c(F)cccc1F ZINC000501145487 332627499 /nfs/dbraw/zinc/62/74/99/332627499.db2.gz BZBKZPMCFBNQQD-UHFFFAOYSA-N 0 0 299.660 4.105 20 5 CIBDRN Cc1cc(C)cc(NC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000502568172 332665789 /nfs/dbraw/zinc/66/57/89/332665789.db2.gz FGGBKGKUHZITQJ-UHFFFAOYSA-N 0 0 299.330 4.164 20 5 CIBDRN Cc1c(NC(=O)CCCC(C)(C)C)cccc1[N+](=O)[O-] ZINC000504453028 332712405 /nfs/dbraw/zinc/71/24/05/332712405.db2.gz JTBQIODTWRPUBX-UHFFFAOYSA-N 0 0 278.352 4.058 20 5 CIBDRN Cc1ccccc1SCc1c(F)cccc1[N+](=O)[O-] ZINC000504548574 332714577 /nfs/dbraw/zinc/71/45/77/332714577.db2.gz QIQRSQDFRNZPNC-UHFFFAOYSA-N 0 0 277.320 4.335 20 5 CIBDRN CC(C)OCc1ccc(Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000512809523 332987380 /nfs/dbraw/zinc/98/73/80/332987380.db2.gz URRNDXUYASFDRP-UHFFFAOYSA-N 0 0 286.331 4.263 20 5 CIBDRN O=[N+]([O-])c1ccc(Sc2cc(F)ccc2F)c(F)c1 ZINC000513096077 333003897 /nfs/dbraw/zinc/00/38/97/333003897.db2.gz NCKQYLTZPKCWQS-UHFFFAOYSA-N 0 0 285.246 4.163 20 5 CIBDRN Cc1ncccc1/C=C/c1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000184766581 333132180 /nfs/dbraw/zinc/13/21/80/333132180.db2.gz XNBDOZXQRRNQEB-GQCTYLIASA-N 0 0 291.310 4.017 20 5 CIBDRN Cc1cc([C@H](C)Nc2cccc(C)c2[N+](=O)[O-])c(C)o1 ZINC000218844497 333136926 /nfs/dbraw/zinc/13/69/26/333136926.db2.gz NXCUYHKJXPCRGZ-NSHDSACASA-N 0 0 274.320 4.286 20 5 CIBDRN O=[N+]([O-])c1ccc(Nc2ccc3ncsc3c2)c(F)c1 ZINC000195667232 333260131 /nfs/dbraw/zinc/26/01/31/333260131.db2.gz VPJQOUIWKVIMFX-UHFFFAOYSA-N 0 0 289.291 4.087 20 5 CIBDRN O=[N+]([O-])c1ccc(N[C@H](Cc2ccccc2)C2CC2)cc1 ZINC000522980027 333302865 /nfs/dbraw/zinc/30/28/65/333302865.db2.gz DBLVKPACGDKEFL-QGZVFWFLSA-N 0 0 282.343 4.028 20 5 CIBDRN C[C@@H](Sc1ncccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000065692339 333600125 /nfs/dbraw/zinc/60/01/25/333600125.db2.gz APRDASZJQOXMKT-MRVPVSSYSA-N 0 0 296.298 4.121 20 5 CIBDRN Cc1cc(NC(=O)C[C@@H](C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000538550050 333605321 /nfs/dbraw/zinc/60/53/21/333605321.db2.gz QSMCJKCQKNLIDG-GFCCVEGCSA-N 0 0 298.342 4.036 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)Nc1ccc(F)c(F)c1 ZINC000540747520 333745005 /nfs/dbraw/zinc/74/50/05/333745005.db2.gz JTNGAKVZFPFTEE-JTQLQIEISA-N 0 0 292.285 4.355 20 5 CIBDRN Cc1ccc(C)c(Oc2nc(C)cc(C)c2[N+](=O)[O-])c1 ZINC000542864724 333846045 /nfs/dbraw/zinc/84/60/45/333846045.db2.gz SCSQQWCCEKQHQV-UHFFFAOYSA-N 0 0 272.304 4.016 20 5 CIBDRN O=[N+]([O-])c1cccc(-c2noc([C@H]3CC34CCCCC4)n2)c1 ZINC000546226981 334020491 /nfs/dbraw/zinc/02/04/91/334020491.db2.gz ZBCYGHDLQKHXFV-CYBMUJFWSA-N 0 0 299.330 4.083 20 5 CIBDRN O=[N+]([O-])c1cccc(-c2noc([C@@H]3CC34CCCCC4)n2)c1 ZINC000546226984 334020505 /nfs/dbraw/zinc/02/05/05/334020505.db2.gz ZBCYGHDLQKHXFV-ZDUSSCGKSA-N 0 0 299.330 4.083 20 5 CIBDRN O=[N+]([O-])c1ccc(-c2noc([C@@H]3CC34CCCCC4)n2)cc1 ZINC000546261202 334023577 /nfs/dbraw/zinc/02/35/77/334023577.db2.gz HWPACHYNELSFQH-ZDUSSCGKSA-N 0 0 299.330 4.083 20 5 CIBDRN CC[C@H](CC(F)(F)F)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000546882668 334053740 /nfs/dbraw/zinc/05/37/40/334053740.db2.gz MGTMMFIMYNVXAB-SSDOTTSWSA-N 0 0 296.676 4.391 20 5 CIBDRN Cc1cc([N+](=O)[O-])ccc1-c1noc(/C=C\C(C)(C)C)n1 ZINC000547102149 334066541 /nfs/dbraw/zinc/06/65/41/334066541.db2.gz DFJALUNNAVZZQP-FPLPWBNLSA-N 0 0 287.319 4.013 20 5 CIBDRN C/C(=C/c1nc([C@H](C)C2CC2)no1)c1ccc([N+](=O)[O-])cc1 ZINC000547213922 334073370 /nfs/dbraw/zinc/07/33/70/334073370.db2.gz RXSRPXJSRMNYBP-DWOQACPDSA-N 0 0 299.330 4.052 20 5 CIBDRN CC(=O)c1ccc(NCc2cccc([N+](=O)[O-])c2C)cc1C ZINC000135070016 334114536 /nfs/dbraw/zinc/11/45/36/334114536.db2.gz XIMPXOZHIJFFBG-UHFFFAOYSA-N 0 0 298.342 4.026 20 5 CIBDRN CC(C)(CNc1ccc(Cl)cc1[N+](=O)[O-])C(F)(F)F ZINC000548872122 334177985 /nfs/dbraw/zinc/17/79/85/334177985.db2.gz NVGYWJKNAYZZCN-UHFFFAOYSA-N 0 0 296.676 4.249 20 5 CIBDRN Cc1cccc(N[C@H]2CSc3ccccc32)c1[N+](=O)[O-] ZINC000549143063 334186440 /nfs/dbraw/zinc/18/64/40/334186440.db2.gz TZNGDQDHVDDIBY-ZDUSSCGKSA-N 0 0 286.356 4.162 20 5 CIBDRN O=[N+]([O-])c1ccc(Oc2ccc(Cl)c(Cl)c2)cn1 ZINC000550328513 334220241 /nfs/dbraw/zinc/22/02/41/334220241.db2.gz UJPUEWHZOHUOFB-UHFFFAOYSA-N 0 0 285.086 4.089 20 5 CIBDRN CCc1ccc(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000086167679 334304373 /nfs/dbraw/zinc/30/43/73/334304373.db2.gz NJNNOSFHHURFCT-UHFFFAOYSA-N 0 0 298.342 4.026 20 5 CIBDRN C[C@@H](c1cccc([N+](=O)[O-])c1)N1C[C@H](C)c2ccccc21 ZINC000552344093 334319009 /nfs/dbraw/zinc/31/90/09/334319009.db2.gz XYXLHHALXGQMFM-STQMWFEESA-N 0 0 282.343 4.280 20 5 CIBDRN Cc1ccc2c(c1)[C@@H](Nc1ccc([N+](=O)[O-])c(C)n1)CCC2 ZINC000566994583 334672472 /nfs/dbraw/zinc/67/24/72/334672472.db2.gz AXNZPMRBYZUOTD-HNNXBMFYSA-N 0 0 297.358 4.096 20 5 CIBDRN Cc1ccc(-c2noc([C@@H](C)CC(C)C)n2)cc1[N+](=O)[O-] ZINC000568078803 334790587 /nfs/dbraw/zinc/79/05/87/334790587.db2.gz KFSCNPNQUNWAEA-NSHDSACASA-N 0 0 289.335 4.103 20 5 CIBDRN O=[N+]([O-])c1ccc2c(c1)[C@H](Nc1cccc(F)c1)CCC2 ZINC000568353045 334818496 /nfs/dbraw/zinc/81/84/96/334818496.db2.gz GXEGVOBHOMLJIF-MRXNPFEDSA-N 0 0 286.306 4.223 20 5 CIBDRN C[C@H](Nc1cccc2ccncc21)c1cccc([N+](=O)[O-])c1 ZINC000316246657 334818734 /nfs/dbraw/zinc/81/87/34/334818734.db2.gz FFNHTQHWKGRQKI-LBPRGKRZSA-N 0 0 293.326 4.316 20 5 CIBDRN C/C=C/c1ccc(NCc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000577099412 335300067 /nfs/dbraw/zinc/30/00/67/335300067.db2.gz AHGQDIFDXASNJK-ONEGZZNKSA-N 0 0 298.342 4.249 20 5 CIBDRN O=[N+]([O-])c1ccc(Oc2cncc(-c3ccccc3)c2)cc1 ZINC000577687791 335388586 /nfs/dbraw/zinc/38/85/86/335388586.db2.gz RCNBTKBEDBRUFV-UHFFFAOYSA-N 0 0 292.294 4.449 20 5 CIBDRN CC1(C)CC[C@@H](Nc2ccc([N+](=O)[O-])nc2)c2ccccc21 ZINC000578046403 335471488 /nfs/dbraw/zinc/47/14/88/335471488.db2.gz WQFHBGSMGNSUNW-OAHLLOKOSA-N 0 0 297.358 4.214 20 5 CIBDRN O=[N+]([O-])c1cccnc1SCc1cccc(F)c1Cl ZINC000578996758 335697713 /nfs/dbraw/zinc/69/77/13/335697713.db2.gz OOZHPIZITZHRIY-UHFFFAOYSA-N 0 0 298.726 4.075 20 5 CIBDRN Cc1ccnc(Sc2ccc(F)c(Cl)c2)c1[N+](=O)[O-] ZINC000579277751 335730752 /nfs/dbraw/zinc/73/07/52/335730752.db2.gz PXBANSOCTCQULG-UHFFFAOYSA-N 0 0 298.726 4.242 20 5 CIBDRN Cc1c([C@@H](C)Nc2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000182682479 335836545 /nfs/dbraw/zinc/83/65/45/335836545.db2.gz ZEGYBFHYQHAKTN-LLVKDONJSA-N 0 0 274.295 4.215 20 5 CIBDRN COc1ccc(SCc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000380927406 336039759 /nfs/dbraw/zinc/03/97/59/336039759.db2.gz NDJVQBYBCZXHEF-UHFFFAOYSA-N 0 0 293.319 4.035 20 5 CIBDRN CC(C)(C)c1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000385488875 336149150 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298.726 4.075 20 5 CIBDRN Cc1ccc([N+](=O)[O-])cc1[C@H](C)SCC[C@H]1CCCO1 ZINC000468631275 331437796 /nfs/dbraw/zinc/43/77/96/331437796.db2.gz OXQAKLRQOGYLHW-GXTWGEPZSA-N 0 0 295.404 4.267 20 5 CIBDRN Cc1cc(N[C@H]2CCC[C@@H]2c2ccccc2)ncc1[N+](=O)[O-] ZINC000470866293 331493100 /nfs/dbraw/zinc/49/31/00/331493100.db2.gz LKCVWDOBPLAFGC-CABCVRRESA-N 0 0 297.358 4.046 20 5 CIBDRN CCSc1cccc(/C=C\c2ccc([N+](=O)[O-])cn2)c1 ZINC000471440753 331508545 /nfs/dbraw/zinc/50/85/45/331508545.db2.gz AXGRXSDZMVQROG-SREVYHEPSA-N 0 0 286.356 4.272 20 5 CIBDRN Cc1ccc2c(c1C)OC[C@@H]2Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000476466240 331664562 /nfs/dbraw/zinc/66/45/62/331664562.db2.gz WWZRSXGMAKZRSH-HNNXBMFYSA-N 0 0 298.342 4.066 20 5 CIBDRN Cc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2)ccc1C1CC1 ZINC000478057131 331696968 /nfs/dbraw/zinc/69/69/68/331696968.db2.gz INKOPUYUPMTSSI-UHFFFAOYSA-N 0 0 296.326 4.033 20 5 CIBDRN Cc1cc(NCc2csc([N+](=O)[O-])c2)ccc1C1CC1 ZINC000478305572 331703414 /nfs/dbraw/zinc/70/34/14/331703414.db2.gz 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C[C@@H](CC(C)(C)C)c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000569288261 334865441 /nfs/dbraw/zinc/86/54/41/334865441.db2.gz AHXHGJZANZZUSN-JTQLQIEISA-N 0 0 289.335 4.185 20 5 CIBDRN CO[C@@H](CSc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000577653782 335386458 /nfs/dbraw/zinc/38/64/58/335386458.db2.gz QBGVKIGUFWYEAC-HNNXBMFYSA-N 0 0 289.356 4.075 20 5 CIBDRN CC(C)c1ccc(-c2nc(-c3ccco3)no2)cc1[N+](=O)[O-] ZINC000578087186 335485424 /nfs/dbraw/zinc/48/54/24/335485424.db2.gz FZTKQQPQRIDINA-UHFFFAOYSA-N 0 0 299.286 4.028 20 5 CIBDRN CC(=O)c1cc(NC[C@H](C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000579508166 335777762 /nfs/dbraw/zinc/77/77/62/335777762.db2.gz ZTAIYZLORFJVMR-LBPRGKRZSA-N 0 0 298.342 4.013 20 5 CIBDRN Cc1csc(CNc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000385986693 336163775 /nfs/dbraw/zinc/16/37/75/336163775.db2.gz PBNWRHBMCPYAIM-UHFFFAOYSA-N 0 0 282.752 4.230 20 5 CIBDRN CC(=O)c1ccc(Sc2cccc(C)c2)c([N+](=O)[O-])c1 ZINC000040696280 518410770 /nfs/dbraw/zinc/41/07/70/518410770.db2.gz PHJKRGNGZJIPMU-UHFFFAOYSA-N 0 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C[C@@H](Nc1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000020089486 170989269 /nfs/dbraw/zinc/98/92/69/170989269.db2.gz BJELDYLVYFQZPB-SECBINFHSA-N 0 0 278.258 4.046 20 5 CIBDRN Cc1ccc(F)c(N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000020358753 171158327 /nfs/dbraw/zinc/15/83/27/171158327.db2.gz WSDQKEKMTWNQQB-LLVKDONJSA-N 0 0 274.295 4.215 20 5 CIBDRN Cc1ccccc1N[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000020526122 171239077 /nfs/dbraw/zinc/23/90/77/171239077.db2.gz YCYABNRHOJKLAH-GFCCVEGCSA-N 0 0 256.305 4.076 20 5 CIBDRN CCCc1ccc(NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000021044100 171293907 /nfs/dbraw/zinc/29/39/07/171293907.db2.gz GKCBCIITWVFYHT-UHFFFAOYSA-N 0 0 270.332 4.159 20 5 CIBDRN C[C@H](Nc1ccc([N+](=O)[O-])c2ncccc12)c1cccs1 ZINC000035134975 172001606 /nfs/dbraw/zinc/00/16/06/172001606.db2.gz XZPUOWXQPKYWQD-JTQLQIEISA-N 0 0 299.355 4.378 20 5 CIBDRN O=[N+]([O-])c1ccccc1CNc1ccc2ccccc2c1 ZINC000035141329 172009310 /nfs/dbraw/zinc/00/93/10/172009310.db2.gz AOGMIXOPNUVWJV-UHFFFAOYSA-N 0 0 278.311 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Cc1cc(F)ccc1NCc1c(Cl)cccc1[N+](=O)[O-] ZINC000111333228 328346988 /nfs/dbraw/zinc/34/69/88/328346988.db2.gz XAUZWZPWLUQTEO-UHFFFAOYSA-N 0 0 294.713 4.308 20 5 CIBDRN Cc1ccc(NCc2c(Cl)cccc2[N+](=O)[O-])cc1C ZINC000111333146 328347037 /nfs/dbraw/zinc/34/70/37/328347037.db2.gz XPWUIQNSLMGPFY-UHFFFAOYSA-N 0 0 290.750 4.477 20 5 CIBDRN O=[N+]([O-])c1cccc(Cl)c1CNc1c(F)cccc1F ZINC000111333349 328347296 /nfs/dbraw/zinc/34/72/96/328347296.db2.gz YHRDKYZICXBXMU-UHFFFAOYSA-N 0 0 298.676 4.139 20 5 CIBDRN CC1(CNc2ccc([N+](=O)[O-])c3cnccc23)CCCC1 ZINC000111617830 328370481 /nfs/dbraw/zinc/37/04/81/328370481.db2.gz UVRQMAVSMSIHNE-UHFFFAOYSA-N 0 0 285.347 4.135 20 5 CIBDRN O=[N+]([O-])c1ccc(CNc2cc(F)cc(F)c2)c(Cl)c1 ZINC000049963233 328380116 /nfs/dbraw/zinc/38/01/16/328380116.db2.gz NVFUNDNKCJJGAK-UHFFFAOYSA-N 0 0 298.676 4.139 20 5 CIBDRN CCc1ccccc1NCc1c(F)cc([N+](=O)[O-])cc1F ZINC000506279668 332768400 /nfs/dbraw/zinc/76/84/00/332768400.db2.gz LEAARQZVZXTTAD-UHFFFAOYSA-N 0 0 292.285 4.048 20 5 CIBDRN CCCCC(=O)N(c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000109734699 326865980 /nfs/dbraw/zinc/86/59/80/326865980.db2.gz UAQJPGQIRQWCAS-UHFFFAOYSA-N 0 0 290.363 4.061 20 5 CIBDRN C/C=C/c1ccc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000557935422 327035816 /nfs/dbraw/zinc/03/58/16/327035816.db2.gz KABMGHOGKAQMAV-ONEGZZNKSA-N 0 0 296.326 4.189 20 5 CIBDRN O=[N+]([O-])c1cc(COc2cc(Cl)ccc2F)cs1 ZINC000533813777 327092603 /nfs/dbraw/zinc/09/26/03/327092603.db2.gz BJYNHBVNFQIYHV-UHFFFAOYSA-N 0 0 287.699 4.028 20 5 CIBDRN CC(C)(CNc1ccc([N+](=O)[O-])cc1Cl)C(F)(F)F ZINC000558689099 327114294 /nfs/dbraw/zinc/11/42/94/327114294.db2.gz UQQGVMVDBSAEBB-UHFFFAOYSA-N 0 0 296.676 4.249 20 5 CIBDRN Cc1cc(F)cc(N[C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000091509646 327170557 /nfs/dbraw/zinc/17/05/57/327170557.db2.gz BUIIYFMDLLVAAN-LLVKDONJSA-N 0 0 274.295 4.215 20 5 CIBDRN CCCn1c2ccccc2nc1-c1ccc([N+](=O)[O-])cc1 ZINC000215869531 327213040 /nfs/dbraw/zinc/21/30/40/327213040.db2.gz QFQIXTLLPUDHED-UHFFFAOYSA-N 0 0 281.315 4.022 20 5 CIBDRN CCC[C@@H](CC)Sc1ncnc2sc([N+](=O)[O-])cc21 ZINC000561317409 327385328 /nfs/dbraw/zinc/38/53/28/327385328.db2.gz DGMMRYNAAJTDQC-MRVPVSSYSA-N 0 0 297.405 4.270 20 5 CIBDRN O=[N+]([O-])c1cc(Cl)c(Sc2ncco2)c(Cl)c1 ZINC000561326462 327386119 /nfs/dbraw/zinc/38/61/19/327386119.db2.gz WJNHODDUYWPEKP-UHFFFAOYSA-N 0 0 291.115 4.041 20 5 CIBDRN Cc1cccnc1SCc1ccc([N+](=O)[O-])cc1Cl ZINC000561524901 327401214 /nfs/dbraw/zinc/40/12/14/327401214.db2.gz BLFLLAXRZSTFBK-UHFFFAOYSA-N 0 0 294.763 4.244 20 5 CIBDRN Cc1csc(CNc2ccc3ncccc3c2[N+](=O)[O-])c1 ZINC000393323799 329085564 /nfs/dbraw/zinc/08/55/64/329085564.db2.gz KLWYDAIGITWUQR-UHFFFAOYSA-N 0 0 299.355 4.125 20 5 CIBDRN Cc1occc1S[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000181290854 329230015 /nfs/dbraw/zinc/23/00/15/329230015.db2.gz GETRORNCSTVECP-SNVBAGLBSA-N 0 0 263.318 4.350 20 5 CIBDRN Cc1cscc1N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000395737327 329300565 /nfs/dbraw/zinc/30/05/65/329300565.db2.gz RQBJXKORIJUVNW-JTQLQIEISA-N 0 0 262.334 4.138 20 5 CIBDRN C[C@H]1C[C@H](C)N1C(=O)c1cc2ccccc2c2cccnc12 ZINC000525940730 329398164 /nfs/dbraw/zinc/39/81/64/329398164.db2.gz JAHKOBOINUJRIL-STQMWFEESA-N 0 0 290.366 4.011 20 5 CIBDRN COC1(CCS[C@H](C)c2ccccc2[N+](=O)[O-])CCC1 ZINC000419497474 329737803 /nfs/dbraw/zinc/73/78/03/329737803.db2.gz XMWQCXTZTVONMK-GFCCVEGCSA-N 0 0 295.404 4.348 20 5 CIBDRN CC[C@@H](Nc1ccc2c(c1)CCN2)c1cccc([N+](=O)[O-])c1 ZINC000423212682 330178071 /nfs/dbraw/zinc/17/80/71/330178071.db2.gz JASBGDAEKRFNCL-MRXNPFEDSA-N 0 0 297.358 4.126 20 5 CIBDRN O=[N+]([O-])c1cnc(Oc2ccc(Cl)c(Cl)c2)s1 ZINC000032211293 330237752 /nfs/dbraw/zinc/23/77/52/330237752.db2.gz RGHCLYRLIAWWTP-UHFFFAOYSA-N 0 0 291.115 4.150 20 5 CIBDRN O=[N+]([O-])c1ccc2oc(CSc3cccs3)nc2c1 ZINC000083091942 330479947 /nfs/dbraw/zinc/47/99/47/330479947.db2.gz BHHYHICTKSPIMM-UHFFFAOYSA-N 0 0 292.341 4.090 20 5 CIBDRN Cc1cc(C)c([C@@H](C)Oc2cccnc2[N+](=O)[O-])c(C)c1 ZINC000516147757 330487515 /nfs/dbraw/zinc/48/75/15/330487515.db2.gz VZYMFCIRDMVFOV-CYBMUJFWSA-N 0 0 286.331 4.055 20 5 CIBDRN O=[N+]([O-])c1cccc(Cl)c1NCCCC(F)(F)F ZINC000149629422 330576675 /nfs/dbraw/zinc/57/66/75/330576675.db2.gz DXZFHUIYLOOTRZ-UHFFFAOYSA-N 0 0 282.649 4.003 20 5 CIBDRN O=[N+]([O-])c1ccccc1N1CC2(CCC2)[C@H]1c1ccccc1 ZINC000432130698 330593341 /nfs/dbraw/zinc/59/33/41/330593341.db2.gz SEDCGYWAAAUFKI-QGZVFWFLSA-N 0 0 294.354 4.326 20 5 CIBDRN Cc1c(CSC[C@@H](C)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000439025871 330732571 /nfs/dbraw/zinc/73/25/71/330732571.db2.gz GXFMSQNIBUZEGU-MRVPVSSYSA-N 0 0 293.310 4.335 20 5 CIBDRN Cc1cc(N[C@@H](C)c2ccc(Cl)cn2)ccc1[N+](=O)[O-] ZINC000439116856 330734053 /nfs/dbraw/zinc/73/40/53/330734053.db2.gz HIKJSNBSTLEHHN-JTQLQIEISA-N 0 0 291.738 4.125 20 5 CIBDRN CSc1ccccc1[C@H](C)Nc1ccc([N+](=O)[O-])cc1 ZINC000440678207 330753934 /nfs/dbraw/zinc/75/39/34/330753934.db2.gz UOFIEGXNRXFFIF-NSHDSACASA-N 0 0 288.372 4.490 20 5 CIBDRN O=[N+]([O-])c1ccccc1CSc1cccc(F)c1 ZINC000440843485 330757067 /nfs/dbraw/zinc/75/70/67/330757067.db2.gz GTTFCRGKBCRFSA-UHFFFAOYSA-N 0 0 263.293 4.026 20 5 CIBDRN CCCN(C(=O)[C@H](C)CC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000441433466 330768643 /nfs/dbraw/zinc/76/86/43/330768643.db2.gz ZTSMGGTWQYDOMQ-CYBMUJFWSA-N 0 0 292.379 4.020 20 5 CIBDRN C[C@H](Nc1ncc([N+](=O)[O-])s1)c1cccc(C2CC2)c1 ZINC000450559639 330986461 /nfs/dbraw/zinc/98/64/61/330986461.db2.gz OTNANMIIOPCQTP-VIFPVBQESA-N 0 0 289.360 4.102 20 5 CIBDRN CC(C)(C)OC1CC(Sc2cccc([N+](=O)[O-])c2)C1 ZINC000450950797 331008567 /nfs/dbraw/zinc/00/85/67/331008567.db2.gz NZHQMFPLCVEIHD-UHFFFAOYSA-N 0 0 281.377 4.033 20 5 CIBDRN O=[N+]([O-])c1ccc(-c2nc(CSC3CCC3)co2)cc1 ZINC000450987056 331010398 /nfs/dbraw/zinc/01/03/98/331010398.db2.gz SYOTXDRLRSWCEQ-UHFFFAOYSA-N 0 0 290.344 4.036 20 5 CIBDRN CCC[C@H](Nc1ncc([N+](=O)[O-])s1)c1ccccc1 ZINC000195506232 331175663 /nfs/dbraw/zinc/17/56/63/331175663.db2.gz JHTTZYRGQAKJTM-NSHDSACASA-N 0 0 277.349 4.005 20 5 CIBDRN Cc1ccc(Cl)cc1OCc1c(F)cccc1[N+](=O)[O-] ZINC000462682933 331325051 /nfs/dbraw/zinc/32/50/51/331325051.db2.gz RRDCGMSKBYXZRU-UHFFFAOYSA-N 0 0 295.697 4.275 20 5 CIBDRN CC1(C)CCCN(c2ccc([N+](=O)[O-])c3cnccc32)CC1 ZINC000462894601 331334197 /nfs/dbraw/zinc/33/41/97/331334197.db2.gz NTFNPLRSOZOKCZ-UHFFFAOYSA-N 0 0 299.374 4.160 20 5 CIBDRN CC(C)[C@@H](C)Sc1ccc([N+](=O)[O-])c2cnccc12 ZINC000463029855 331337614 /nfs/dbraw/zinc/33/76/14/331337614.db2.gz QKFQOGIGJMFUTR-SNVBAGLBSA-N 0 0 276.361 4.280 20 5 CIBDRN Cc1cnc(N[C@H]2CCC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000463052761 331338679 /nfs/dbraw/zinc/33/86/79/331338679.db2.gz GPVNNMBWZCBIPC-CABCVRRESA-N 0 0 297.358 4.046 20 5 CIBDRN Cc1cnc(N[C@H]2CCC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000463052762 331338751 /nfs/dbraw/zinc/33/87/51/331338751.db2.gz GPVNNMBWZCBIPC-GJZGRUSLSA-N 0 0 297.358 4.046 20 5 CIBDRN Cc1ccc([C@H](C)N(C)c2ncc(C)cc2[N+](=O)[O-])c(C)c1 ZINC000463055999 331338906 /nfs/dbraw/zinc/33/89/06/331338906.db2.gz PXSFXFFNWBKQBK-AWEZNQCLSA-N 0 0 299.374 4.112 20 5 CIBDRN Cc1cnc(N[C@@H](c2ccccc2C)C2CC2)c([N+](=O)[O-])c1 ZINC000463060628 331339080 /nfs/dbraw/zinc/33/90/80/331339080.db2.gz KUBJORKIFWHDSR-MRXNPFEDSA-N 0 0 297.358 4.170 20 5 CIBDRN CCC[C@@]1(C)CCCN(c2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000463068324 331339217 /nfs/dbraw/zinc/33/92/17/331339217.db2.gz KMVUHIXUQSXHDF-INIZCTEOSA-N 0 0 292.379 4.010 20 5 CIBDRN C[C@@H](CNc1ccccc1[N+](=O)[O-])Sc1ccccc1 ZINC000463076598 331339691 /nfs/dbraw/zinc/33/96/91/331339691.db2.gz KCSLWKFVZZJHRU-LBPRGKRZSA-N 0 0 288.372 4.188 20 5 CIBDRN CC(C)[C@H](C)SCc1c(F)cccc1[N+](=O)[O-] ZINC000463227747 331343093 /nfs/dbraw/zinc/34/30/93/331343093.db2.gz BRMRBGNXNWLJLL-VIFPVBQESA-N 0 0 257.330 4.012 20 5 CIBDRN CCc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)C(CC)CC ZINC000464721573 331365315 /nfs/dbraw/zinc/36/53/15/331365315.db2.gz XPLFRJZKWSJGCW-NSHDSACASA-N 0 0 292.379 4.168 20 5 CIBDRN CC[C@@H](C)CSCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000464801056 331369010 /nfs/dbraw/zinc/36/90/10/331369010.db2.gz CTONWPOZAQBTBX-SECBINFHSA-N 0 0 280.349 4.015 20 5 CIBDRN O=[N+]([O-])c1ccc(S[C@@H]2CCCc3ccccc32)nc1 ZINC000466824716 331405610 /nfs/dbraw/zinc/40/56/10/331405610.db2.gz KNPXJQXSJNISOX-CQSZACIVSA-N 0 0 286.356 4.160 20 5 CIBDRN O=[N+]([O-])c1ccc2nc(/C=C\c3cccc(O)c3)ccc2c1 ZINC000471476033 331509211 /nfs/dbraw/zinc/50/92/11/331509211.db2.gz MDQKDHNGLGYCIR-XQRVVYSFSA-N 0 0 292.294 4.019 20 5 CIBDRN O=[N+]([O-])c1cc(Cl)ccc1N[C@@H]1CCCC(F)(F)C1 ZINC000471543115 331510166 /nfs/dbraw/zinc/51/01/66/331510166.db2.gz XCPNMJRFFALODO-SECBINFHSA-N 0 0 290.697 4.238 20 5 CIBDRN Cc1cc(OCCCCC(F)(F)F)c(F)cc1[N+](=O)[O-] ZINC000478890843 331716052 /nfs/dbraw/zinc/71/60/52/331716052.db2.gz UOKLFZYFJYGPRC-UHFFFAOYSA-N 0 0 295.232 4.154 20 5 CIBDRN CC(C)C[C@@H](Nc1ncccc1[N+](=O)[O-])c1ccccc1 ZINC000484162042 331893777 /nfs/dbraw/zinc/89/37/77/331893777.db2.gz JCNHOUZZYJLXJR-CQSZACIVSA-N 0 0 285.347 4.189 20 5 CIBDRN C[C@H](SC[C@@H]1CCO[C@H](C)C1)c1ccccc1[N+](=O)[O-] ZINC000485559766 331916711 /nfs/dbraw/zinc/91/67/11/331916711.db2.gz JLQNCAORKUBSIL-FRRDWIJNSA-N 0 0 295.404 4.204 20 5 CIBDRN Cc1ccc(NC(=O)[C@@H](C)CC2CCCC2)cc1[N+](=O)[O-] ZINC000303525726 332935445 /nfs/dbraw/zinc/93/54/45/332935445.db2.gz GCDJJWLVXCTQMZ-LBPRGKRZSA-N 0 0 290.363 4.058 20 5 CIBDRN O=[N+]([O-])c1ccc(OCc2cc3ccccc3o2)c(F)c1 ZINC000486886795 331948415 /nfs/dbraw/zinc/94/84/15/331948415.db2.gz YLDSCVHFBLICNS-UHFFFAOYSA-N 0 0 287.246 4.059 20 5 CIBDRN O=[N+]([O-])c1ccc(CNc2ccc(C3CCC3)cc2)cc1 ZINC000487175288 331958262 /nfs/dbraw/zinc/95/82/62/331958262.db2.gz YUBYETOCTAFPKM-UHFFFAOYSA-N 0 0 282.343 4.474 20 5 CIBDRN Cc1ccc2c(c1)CC[C@H]2Nc1ccccc1[N+](=O)[O-] ZINC000511694594 332939834 /nfs/dbraw/zinc/93/98/34/332939834.db2.gz DBKLTWFSQWBVBV-CQSZACIVSA-N 0 0 268.316 4.003 20 5 CIBDRN O=[N+]([O-])c1cccnc1N[C@@H]1CCCC[C@@H]1c1ccccc1 ZINC000511710107 332940191 /nfs/dbraw/zinc/94/01/91/332940191.db2.gz JHKOPRJEBVMQIK-HUUCEWRRSA-N 0 0 297.358 4.128 20 5 CIBDRN C[C@H](Nc1ccc2scnc2c1)c1ccccc1[N+](=O)[O-] ZINC000488477555 332012622 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270.332 4.330 20 5 CIBDRN CCOc1ccccc1N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000020525952 262245211 /nfs/dbraw/zinc/24/52/11/262245211.db2.gz ZEASNGMPDFQDMV-LBPRGKRZSA-N 0 0 286.331 4.167 20 5 CIBDRN Cc1ccc([C@H](C)Nc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000020556783 262250820 /nfs/dbraw/zinc/25/08/20/262250820.db2.gz ZDXDAQFWTWFANJ-NSHDSACASA-N 0 0 274.295 4.215 20 5 CIBDRN Cc1ccc([C@@H](C)Nc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000021027088 262374289 /nfs/dbraw/zinc/37/42/89/262374289.db2.gz MLPULUZSAOCEDG-LLVKDONJSA-N 0 0 274.295 4.215 20 5 CIBDRN Cc1ccc(Oc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cn1 ZINC000160841624 264261935 /nfs/dbraw/zinc/26/19/35/264261935.db2.gz BZIHJTUINOCWQD-UHFFFAOYSA-N 0 0 298.220 4.109 20 5 CIBDRN CCC(=O)c1ccc(O[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000096956296 265394584 /nfs/dbraw/zinc/39/45/84/265394584.db2.gz FEIOHLKSQDUWNZ-LBPRGKRZSA-N 0 0 299.326 4.328 20 5 CIBDRN C[C@H]1CCC[C@H](c2noc(-c3ccc([N+](=O)[O-])s3)n2)C1 ZINC000356222486 266074481 /nfs/dbraw/zinc/07/44/81/266074481.db2.gz PRCJSWSLBJRDLR-IUCAKERBSA-N 0 0 293.348 4.000 20 5 CIBDRN Cc1cc([N+](=O)[O-])ccc1NCc1ccc2ccccc2n1 ZINC000387765738 327810343 /nfs/dbraw/zinc/81/03/43/327810343.db2.gz GRZIDFLMBCUNPL-UHFFFAOYSA-N 0 0 293.326 4.064 20 5 CIBDRN Cc1cscc1CNc1cc(C)c([N+](=O)[O-])cc1F ZINC000388366702 327874857 /nfs/dbraw/zinc/87/48/57/327874857.db2.gz HUDFDBTVLUZVPN-UHFFFAOYSA-N 0 0 280.324 4.024 20 5 CIBDRN Cc1ccc(CSc2ncccc2[N+](=O)[O-])c(Cl)c1 ZINC000446060158 327898433 /nfs/dbraw/zinc/89/84/33/327898433.db2.gz LVWOKZNUHHSCHH-UHFFFAOYSA-N 0 0 294.763 4.244 20 5 CIBDRN Cc1c(NC(=O)[C@H]2CCCC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000534414432 328051902 /nfs/dbraw/zinc/05/19/02/328051902.db2.gz ALURFSXGBZQNJO-LBPRGKRZSA-N 0 0 290.363 4.058 20 5 CIBDRN O=[N+]([O-])c1ccccc1N[C@H]1CCc2c1cccc2Cl ZINC000048962727 328326867 /nfs/dbraw/zinc/32/68/67/328326867.db2.gz LTBFOWBBNGCXHF-ZDUSSCGKSA-N 0 0 288.734 4.348 20 5 CIBDRN O=[N+]([O-])c1ccccc1N[C@@H]1CCc2c1cccc2Cl ZINC000048962725 328326908 /nfs/dbraw/zinc/32/69/08/328326908.db2.gz LTBFOWBBNGCXHF-CYBMUJFWSA-N 0 0 288.734 4.348 20 5 CIBDRN Cc1cc(C)cc(NCc2c(F)cc([N+](=O)[O-])cc2F)c1 ZINC000506275098 332767977 /nfs/dbraw/zinc/76/79/77/332767977.db2.gz ZMBFMYPCRKTQEX-UHFFFAOYSA-N 0 0 292.285 4.102 20 5 CIBDRN O=[N+]([O-])c1cccc(Cl)c1CNc1cc(F)cc(F)c1 ZINC000111333232 328347286 /nfs/dbraw/zinc/34/72/86/328347286.db2.gz FWZOMADEAABOFI-UHFFFAOYSA-N 0 0 298.676 4.139 20 5 CIBDRN O=[N+]([O-])c1ccc(CNc2ccc(F)c(F)c2)c(Cl)c1 ZINC000049963176 328379743 /nfs/dbraw/zinc/37/97/43/328379743.db2.gz ICRCUZBADAXMKI-UHFFFAOYSA-N 0 0 298.676 4.139 20 5 CIBDRN Cc1ccc(NCc2ccc([N+](=O)[O-])cc2Cl)cc1C ZINC000049963180 328380051 /nfs/dbraw/zinc/38/00/51/328380051.db2.gz MEFZEENRHGBRQA-UHFFFAOYSA-N 0 0 290.750 4.477 20 5 CIBDRN O=[N+]([O-])c1c(Oc2ccc(F)cc2)ccc2ncccc21 ZINC000112072331 328383656 /nfs/dbraw/zinc/38/36/56/328383656.db2.gz LZUYCACYVQKDRX-UHFFFAOYSA-N 0 0 284.246 4.074 20 5 CIBDRN CCSc1ccccc1OCc1ccccc1[N+](=O)[O-] ZINC000535120138 328388555 /nfs/dbraw/zinc/38/85/55/328388555.db2.gz HXZGLDDTKVADFF-UHFFFAOYSA-N 0 0 289.356 4.286 20 5 CIBDRN CC[C@@H]1CCCC[C@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000474071787 328433021 /nfs/dbraw/zinc/43/30/21/328433021.db2.gz FWIRURGRGKRDDC-TZMCWYRMSA-N 0 0 290.363 4.058 20 5 CIBDRN Cc1c(NC(=O)C(C)(C)C2CCCC2)cccc1[N+](=O)[O-] ZINC000535327656 328441690 /nfs/dbraw/zinc/44/16/90/328441690.db2.gz UGZLZAHUMPVIOY-UHFFFAOYSA-N 0 0 290.363 4.058 20 5 CIBDRN O=[N+]([O-])c1cccc(F)c1OCc1sccc1Cl ZINC000506434458 332772902 /nfs/dbraw/zinc/77/29/02/332772902.db2.gz SZLLQWUGGIGSFB-UHFFFAOYSA-N 0 0 287.699 4.028 20 5 CIBDRN Cc1ccc(Cl)c(OCc2cccc([N+](=O)[O-])c2)c1 ZINC000255936166 327033160 /nfs/dbraw/zinc/03/31/60/327033160.db2.gz YLCUDVDMIDJEKS-UHFFFAOYSA-N 0 0 277.707 4.136 20 5 CIBDRN CCc1cccc2c1OCC[C@@H]2Nc1ccc([N+](=O)[O-])cc1 ZINC000506752168 332779032 /nfs/dbraw/zinc/77/90/32/332779032.db2.gz FRMWVUTWIRIBNB-INIZCTEOSA-N 0 0 298.342 4.093 20 5 CIBDRN O=[N+]([O-])c1cc(Cl)ccc1OC[C@H]1CCC(F)(F)C1 ZINC000584126547 327047164 /nfs/dbraw/zinc/04/71/64/327047164.db2.gz LTNFYCMQVVATQE-QMMMGPOBSA-N 0 0 291.681 4.062 20 5 CIBDRN O=[N+]([O-])c1ncccc1OCc1ccc(C2CCCC2)cc1 ZINC000584180008 327060366 /nfs/dbraw/zinc/06/03/66/327060366.db2.gz VLMUAMUJWOUFOA-UHFFFAOYSA-N 0 0 298.342 4.226 20 5 CIBDRN CC(=O)c1cc(NCCC(C)(C)C2CC2)ccc1[N+](=O)[O-] ZINC000558978852 327135938 /nfs/dbraw/zinc/13/59/38/327135938.db2.gz VMAODSRFFKJQBW-UHFFFAOYSA-N 0 0 290.363 4.036 20 5 CIBDRN Cc1cc(NCc2ccc(C(C)C)cc2)ncc1[N+](=O)[O-] ZINC000092027080 327183882 /nfs/dbraw/zinc/18/38/82/327183882.db2.gz NEJMXHUEZITNSE-UHFFFAOYSA-N 0 0 285.347 4.034 20 5 CIBDRN CC[C@@H](Nc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000043473699 327257798 /nfs/dbraw/zinc/25/77/98/327257798.db2.gz CNVVIKRIFLKVLC-CQSZACIVSA-N 0 0 274.295 4.297 20 5 CIBDRN C/C=C/c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000561651136 327407936 /nfs/dbraw/zinc/40/79/36/327407936.db2.gz JOIKUDGTQGOCLG-ONEGZZNKSA-N 0 0 296.326 4.189 20 5 CIBDRN Cc1nc2ccccc2cc1OCc1ccccc1[N+](=O)[O-] ZINC000562068214 327446337 /nfs/dbraw/zinc/44/63/37/327446337.db2.gz LXMNNASYCRLWMP-UHFFFAOYSA-N 0 0 294.310 4.030 20 5 CIBDRN O=[N+]([O-])c1cccc(F)c1COc1c(F)cccc1Cl ZINC000507331598 332803010 /nfs/dbraw/zinc/80/30/10/332803010.db2.gz GAXXGUVOYMWZQA-UHFFFAOYSA-N 0 0 299.660 4.105 20 5 CIBDRN Cc1ccsc1CNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000051854801 328636040 /nfs/dbraw/zinc/63/60/40/328636040.db2.gz HGSGLNKDCHGHKH-UHFFFAOYSA-N 0 0 299.355 4.125 20 5 CIBDRN Cc1c(CNc2cccc3ccncc32)cccc1[N+](=O)[O-] ZINC000532286601 328713187 /nfs/dbraw/zinc/71/31/87/328713187.db2.gz QXMOSILTGFJINF-UHFFFAOYSA-N 0 0 293.326 4.064 20 5 CIBDRN C[C@@H](SCCCCF)c1ccccc1[N+](=O)[O-] ZINC000507850450 332827572 /nfs/dbraw/zinc/82/75/72/332827572.db2.gz JJWABSUUKFMUJD-SNVBAGLBSA-N 0 0 257.330 4.139 20 5 CIBDRN Cc1occc1S[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000181290839 329229955 /nfs/dbraw/zinc/22/99/55/329229955.db2.gz GETRORNCSTVECP-JTQLQIEISA-N 0 0 263.318 4.350 20 5 CIBDRN O=[N+]([O-])c1ccc(N[C@H]2CCCC[C@H]2c2ccccc2)cn1 ZINC000582868925 329278476 /nfs/dbraw/zinc/27/84/76/329278476.db2.gz NRSOPECTVWTXNV-HOTGVXAUSA-N 0 0 297.358 4.128 20 5 CIBDRN O=[N+]([O-])c1ccc(C(F)(F)F)c(CSCCCF)c1 ZINC000419431513 329728699 /nfs/dbraw/zinc/72/86/99/329728699.db2.gz FPIQLAIPQBHCJY-UHFFFAOYSA-N 0 0 297.273 4.206 20 5 CIBDRN O=[N+]([O-])c1cccc(SCc2ccc3ccccc3n2)c1 ZINC000509699632 332879868 /nfs/dbraw/zinc/87/98/68/332879868.db2.gz QOQRJSNIKPWSTF-UHFFFAOYSA-N 0 0 296.351 4.435 20 5 CIBDRN CC(C)CCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000510000031 332888074 /nfs/dbraw/zinc/88/80/74/332888074.db2.gz YJOYZCHEKIEUEC-UHFFFAOYSA-N 0 0 292.382 4.164 20 5 CIBDRN Cc1ccc(NCc2cccc([N+](=O)[O-])c2C)c(Cl)c1 ZINC000035648848 330248416 /nfs/dbraw/zinc/24/84/16/330248416.db2.gz RFTPVTJHJOJZPQ-UHFFFAOYSA-N 0 0 290.750 4.477 20 5 CIBDRN C[C@H]([NH2+]Cc1cc2ccccc2o1)c1cccc([N+](=O)[O-])c1 ZINC000119708373 330378955 /nfs/dbraw/zinc/37/89/55/330378955.db2.gz XTQDWTPZPWNAKH-LBPRGKRZSA-N 0 0 296.326 4.192 20 5 CIBDRN O=[N+]([O-])c1ccccc1Sc1ccc(F)cc1F ZINC000057877547 330380105 /nfs/dbraw/zinc/38/01/05/330380105.db2.gz LXKYVGRZVLAVSS-UHFFFAOYSA-N 0 0 267.256 4.024 20 5 CIBDRN Cc1cc(N[C@@H](C)c2ccccc2[N+](=O)[O-])ccc1F ZINC000061117387 330428905 /nfs/dbraw/zinc/42/89/05/330428905.db2.gz OQDQOTIZKLDCMK-NSHDSACASA-N 0 0 274.295 4.215 20 5 CIBDRN Cc1cc(N(C)[C@H](C)c2cccs2)ccc1[N+](=O)[O-] ZINC000515480488 330478312 /nfs/dbraw/zinc/47/83/12/330478312.db2.gz GLICYDPISVAKLZ-LLVKDONJSA-N 0 0 276.361 4.162 20 5 CIBDRN Cc1cc(N[C@H]2CSc3ccccc32)ccc1[N+](=O)[O-] ZINC000083748573 330482383 /nfs/dbraw/zinc/48/23/83/330482383.db2.gz IBNXBSDLGABJQR-ZDUSSCGKSA-N 0 0 286.356 4.162 20 5 CIBDRN CC(C)[C@H]1N(c2ccc([N+](=O)[O-])c3cnccc32)CC1(C)C ZINC000431506502 330585894 /nfs/dbraw/zinc/58/58/94/330585894.db2.gz NUKHALQESWHAJJ-MRXNPFEDSA-N 0 0 299.374 4.014 20 5 CIBDRN Cc1nc(C)c(CSCc2ccccc2[N+](=O)[O-])s1 ZINC000437424986 330699410 /nfs/dbraw/zinc/69/94/10/330699410.db2.gz FPSHDBRVFALNPD-UHFFFAOYSA-N 0 0 294.401 4.102 20 5 CIBDRN CSc1ccccc1[C@H](C)Nc1ccccc1[N+](=O)[O-] ZINC000440655015 330753642 /nfs/dbraw/zinc/75/36/42/330753642.db2.gz OHXUDXAVTIYDMN-NSHDSACASA-N 0 0 288.372 4.490 20 5 CIBDRN COc1ccc([N+](=O)[O-])cc1CSc1cccc(F)c1 ZINC000440839285 330756974 /nfs/dbraw/zinc/75/69/74/330756974.db2.gz ATELZGCQQKNHDA-UHFFFAOYSA-N 0 0 293.319 4.035 20 5 CIBDRN C[C@@H](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000441290519 330765038 /nfs/dbraw/zinc/76/50/38/330765038.db2.gz YIXUSYDCQWSGLS-ZDUSSCGKSA-N 0 0 298.342 4.117 20 5 CIBDRN CCCN(C(=O)CC(CC)CC)c1cccc([N+](=O)[O-])c1 ZINC000441446421 330769067 /nfs/dbraw/zinc/76/90/67/330769067.db2.gz IINWYFXNBPIOAA-UHFFFAOYSA-N 0 0 292.379 4.164 20 5 CIBDRN CC(C)C[C@@H](Nc1ncc([N+](=O)[O-])s1)c1cccs1 ZINC000443515325 330800707 /nfs/dbraw/zinc/80/07/07/330800707.db2.gz BRODONVJEYZVTC-SECBINFHSA-N 0 0 297.405 4.312 20 5 CIBDRN CC(C)[C@H](CC(F)(F)F)Nc1ccc([N+](=O)[O-])cc1F ZINC000445662686 330834254 /nfs/dbraw/zinc/83/42/54/330834254.db2.gz CGNJYQFFADJGAS-NSHDSACASA-N 0 0 294.248 4.123 20 5 CIBDRN CC(C)Oc1cccc(NCc2csc([N+](=O)[O-])c2)c1 ZINC000449466140 330927823 /nfs/dbraw/zinc/92/78/23/330927823.db2.gz DUMMZPQRZSVTJL-UHFFFAOYSA-N 0 0 292.360 4.056 20 5 CIBDRN C[C@@H](Nc1ncccc1[N+](=O)[O-])c1cccc(C2CC2)c1 ZINC000450552507 330985939 /nfs/dbraw/zinc/98/59/39/330985939.db2.gz HREFYLNSKUGEKV-LLVKDONJSA-N 0 0 283.331 4.040 20 5 CIBDRN Cc1nc(C(C)C)oc1CSc1cccc([N+](=O)[O-])c1 ZINC000450949699 331008493 /nfs/dbraw/zinc/00/84/93/331008493.db2.gz KUGVIQVZLJTMGJ-UHFFFAOYSA-N 0 0 292.360 4.307 20 5 CIBDRN CCCc1nc(C)c(CSc2cccc([N+](=O)[O-])c2)o1 ZINC000450952801 331008575 /nfs/dbraw/zinc/00/85/75/331008575.db2.gz VIDNLMDPPCKBEC-UHFFFAOYSA-N 0 0 292.360 4.136 20 5 CIBDRN Cc1ccc(N[C@@H](C)CCCC(F)(F)F)c([N+](=O)[O-])c1 ZINC000163300787 331016791 /nfs/dbraw/zinc/01/67/91/331016791.db2.gz FXJVJHHRCJWIIF-JTQLQIEISA-N 0 0 290.285 4.436 20 5 CIBDRN 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281.114 4.063 20 5 CIBDRN O=[N+]([O-])c1cccc(Cl)c1COc1cc(F)ccc1F ZINC000312242018 333078897 /nfs/dbraw/zinc/07/88/97/333078897.db2.gz GZUWLJVYNPEXRD-UHFFFAOYSA-N 0 0 299.660 4.105 20 5 CIBDRN Cc1cccc(N[C@H](C)c2ccc([N+](=O)[O-])cc2)c1F ZINC000312297736 333079720 /nfs/dbraw/zinc/07/97/20/333079720.db2.gz SURJOELVSMCGJJ-LLVKDONJSA-N 0 0 274.295 4.215 20 5 CIBDRN O=[N+]([O-])c1ccc2sc(/C=C/c3ccc(O)cc3)nc2c1 ZINC000007746128 333098638 /nfs/dbraw/zinc/09/86/38/333098638.db2.gz SDZXMRDVECWRLI-FPYGCLRLSA-N 0 0 298.323 4.081 20 5 CIBDRN CC(C)C[N@H+](Cc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000521188583 333114369 /nfs/dbraw/zinc/11/43/69/333114369.db2.gz GXBWYKQIVIWCKP-UHFFFAOYSA-N 0 0 298.386 4.253 20 5 CIBDRN O=[N+]([O-])c1cc(F)ccc1Oc1cnc2ccccc2c1 ZINC000191860134 333226577 /nfs/dbraw/zinc/22/65/77/333226577.db2.gz CULQQUYJHOHGHM-UHFFFAOYSA-N 0 0 284.246 4.074 20 5 CIBDRN Cc1ccc(Cl)c(NCc2csc([N+](=O)[O-])c2)c1 ZINC000230213044 333315591 /nfs/dbraw/zinc/31/55/91/333315591.db2.gz 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CCOc1ccc(O[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000096956322 185140230 /nfs/dbraw/zinc/14/02/30/185140230.db2.gz PTSXNIMGJKMOJM-GFCCVEGCSA-N 0 0 287.315 4.134 20 5 CIBDRN CCOc1ccc(O[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000096956321 185140927 /nfs/dbraw/zinc/14/09/27/185140927.db2.gz PTSXNIMGJKMOJM-LBPRGKRZSA-N 0 0 287.315 4.134 20 5 CIBDRN COc1cc(N[C@H](c2ccccc2)C2CC2)ccc1[N+](=O)[O-] ZINC000301522732 533039818 /nfs/dbraw/zinc/03/98/18/533039818.db2.gz MAOZLRMZJKXRPR-QGZVFWFLSA-N 0 0 298.342 4.167 20 5 CIBDRN CCCCCCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000005461485 170101631 /nfs/dbraw/zinc/10/16/31/170101631.db2.gz HVNCRKSENRGOSF-UHFFFAOYSA-N 0 0 284.743 4.157 20 5 CIBDRN CC(C)(C)c1ccc(Nc2ccc([N+](=O)[O-])cn2)cc1 ZINC000006858846 170250740 /nfs/dbraw/zinc/25/07/40/170250740.db2.gz ROMZXSKTLDTGTG-UHFFFAOYSA-N 0 0 271.320 4.031 20 5 CIBDRN Cc1c(NC(=O)C[C@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000015790920 170678012 /nfs/dbraw/zinc/67/80/12/170678012.db2.gz KOZBJDOPQAVIAS-LBPRGKRZSA-N 0 0 298.342 4.036 20 5 CIBDRN C[C@H](NCc1ccccc1[N+](=O)[O-])c1ccccc1Cl ZINC000020124125 171005818 /nfs/dbraw/zinc/00/58/18/171005818.db2.gz APKBHRCEDOUTJS-NSHDSACASA-N 0 0 290.750 4.099 20 5 CIBDRN Cc1ccc(NCc2cccc([N+](=O)[O-])c2)c(Cl)c1 ZINC000020361015 171159562 /nfs/dbraw/zinc/15/95/62/171159562.db2.gz JHUSZGCFLUWWOE-UHFFFAOYSA-N 0 0 276.723 4.169 20 5 CIBDRN Cc1ccc(NCc2ccccc2[N+](=O)[O-])c(Cl)c1 ZINC000020361023 171159572 /nfs/dbraw/zinc/15/95/72/171159572.db2.gz YNGJVTDJRYQXTJ-UHFFFAOYSA-N 0 0 276.723 4.169 20 5 CIBDRN O=[N+]([O-])c1cccc(-c2csc(-c3cccc(O)c3)n2)c1 ZINC000020432990 171197964 /nfs/dbraw/zinc/19/79/64/171197964.db2.gz RCMKKWKGBVNZKZ-UHFFFAOYSA-N 0 0 298.323 4.091 20 5 CIBDRN O=[N+]([O-])c1ccc(NCc2cccc(C(F)(F)F)c2)cc1 ZINC000021008952 171285489 /nfs/dbraw/zinc/28/54/89/171285489.db2.gz RFYPUORMULCGHD-UHFFFAOYSA-N 0 0 296.248 4.226 20 5 CIBDRN Cc1ccc(F)cc1N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000021801333 171326044 /nfs/dbraw/zinc/32/60/44/171326044.db2.gz 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CCC1(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)CCCC1 ZINC000465445984 331383627 /nfs/dbraw/zinc/38/36/27/331383627.db2.gz BZCOXGVIMKXEHC-UHFFFAOYSA-N 0 0 290.363 4.121 20 5 CIBDRN Cc1cc(N[C@@H]2CCC[C@@H]2c2ccccc2)ncc1[N+](=O)[O-] ZINC000470866295 331493086 /nfs/dbraw/zinc/49/30/86/331493086.db2.gz LKCVWDOBPLAFGC-HUUCEWRRSA-N 0 0 297.358 4.046 20 5 CIBDRN Cc1cc(C)c(C)c(Oc2cc(C)c([N+](=O)[O-])cn2)c1 ZINC000470865803 331493098 /nfs/dbraw/zinc/49/30/98/331493098.db2.gz INUMMOGFTBOTNI-UHFFFAOYSA-N 0 0 272.304 4.016 20 5 CIBDRN Cc1cc(NCc2ccccc2[N+](=O)[O-])ccc1C1CC1 ZINC000478327095 331703947 /nfs/dbraw/zinc/70/39/47/331703947.db2.gz NVYHKVLEWPNMBG-UHFFFAOYSA-N 0 0 282.343 4.393 20 5 CIBDRN O=[N+]([O-])c1cccc(Cl)c1CSCCC(F)(F)F ZINC000478758911 331713584 /nfs/dbraw/zinc/71/35/84/331713584.db2.gz WQLKOTSPFLVZBG-UHFFFAOYSA-N 0 0 299.701 4.434 20 5 CIBDRN O=[N+]([O-])c1ccc(Oc2ccc3cccnc3c2)c(F)c1 ZINC000480551129 331777087 /nfs/dbraw/zinc/77/70/87/331777087.db2.gz HDHBSZJZYIVVPB-UHFFFAOYSA-N 0 0 284.246 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